1. 18-0646
FeNi
Tetrag.
Groupa 130
Dexp. Dcal. d(D) h k l
2.0800 2.0802 -.0002 0 0 2
1.8000 1.7998 .0002 1 0 2
1.2700 1.2691 .0009 2 2 0
1.0830 1.0834 -.0004 2 2 2
1.0370 1.0372 -.0002 3 0 2
.9000 .8999 .0001 2 0 4
a= 3.590 c= 4.160
da= .002 dc= .003
V= 53.61
2. 18-0795
gamma-Ni0.45Si0.40Mn0.15
Triklin
Dexp Dcal d(D) h k l
3.3200 3.3208 -.0008 0 1 0
3.1000 3.1008 -.0008 0 -1 2
2.8800 2.8800 .0000 -1 -1 3
2.4700 2.4699 .0001 -1 -1 5
2.4200 2.4201 -.0001 -2 -1 4
2.2700 2.2706 -.0006 -2 1 4
2.1600 2.1599 .0001 -2 1 5
2.1300 2.1302 -.0002 -2 -1 6
2.0600 2.0608 -.0008 -3 -1 4
2.0300 2.0303 -.0003 1 -1 6
1.9560 1.9554 .0006 -3 1 3
1.9380 1.9383 -.0003 4 0 0
A= 7.944 DA= .002
B= 3.3354 DB= .0002
C= 18.727 DC= .002
GAMMA= 84.79 DGAMMA= .01
BETA =101.42 DBETA = .07
ALPHA= 89.80 DALPHA= .01
V= 484.3
3. 18-0796
omega-Si0.34Mn0.33Ni0.33
Triklin
Dexp Dcal d(D) h k l
4.5100 4.5128 -.0028 0 -1 1
3.0100 3.0104 -.0004 2 -1 1
2.8300 2.8301 -.0001 0 1 3
2.3100 2.3122 -.0022 3 -1 1
2.2400 2.2399 .0001 0 0 4
2.1800 2.1798 .0002 3 0 2
2.1500 2.1500 .0000 2 1 3
2.0400 2.0400 .0000 2 2 2
1.9710 1.9709 .0001 2 -2 2
1.9540 1.9569 -.0029 -4 1 0
1.9000 1.9003 -.0003 -3 -1 3
1.8530 1.8512 .0018 4 1 0
A= 8.193 DA= .004
B= 5.814 DB= .002
C= 9.171 DC= .004
GAMMA= 96.39 DGAMMA= .01
BETA = 98.67 DBETA = .01
ALPHA= 80.40 DALPHA= .03
V= 424.1
4. 18-0797
Ni0.5Si0.35MnO015
Triklin
Dexp Dcal d(D) h k l
2.7900 2.7903 -.0003 2 0 1
2.2800 2.2800 .0000 2 -2 1
2.1700 2.1700 .0000 3 -1 1
2.1300 2.1300 .0000 3 1 1
1.8510 1.8509 .0001 4 0 1
1.8390 1.8383 .0007 -4 2 0
1.7570 1.7559 .0011 -1 4 0
1.6580 1.6581 -.0001 4 -2 1
1.5870 1.5872 -.0002 -5 -2 1
1.5320 1.5321 -.0001 -1 4 1
1.4040 1.4041 -.0001 -1 3 2
1.3540 1.3542 -.0002 -2 5 0
1.3010 1.3011 -.0001 -5 3 1
1.2670 1.2667 .0003 1 -1 3
1.2340 1.2340 -.0000 -7 0 1
A= 8.911 DA= .002
B= 7.351 DB= .001
C= 3.9171 DC= .0001
GAMMA= 85.62 DGAMMA= .05
BETA = 95.615 DBETA = .005
ALPHA= 98.378 DALPHA= .00958
V= 252.1
5. 18-0798
Mn0.55Si0.25Ni0.2
Triklin
Dexp Dcal d(D) h k l
2.2700 2.2691 .0009 3 1 0
2.2300 2.2304 -.0004 -4 1 0
2.1800 2.1807 -.0007 1 3 0
2.1400 2.1400 .0000 0 1 2
2.0800 2.0800 .0000 1 -4 0
2.0600 2.0595 .0005 -1 0 2
2.0300 2.0300 -.0000 1 -1 2
2.0100 2.0110 -.0010 -1 2 2
1.9800 1.9796 .0004 0 2 2
1.9590 1.9587 .0003 -2 1 2
1.9170 1.9164 .0006 0 4 0
1.8860 1.8862 -.0002 -1 -1 2
A= 9.086 DA= .002
B= 8.583 DB= .001
C= 4.3376 DC= .0001
GAMMA=115.94 DGAMMA= .01
BETA = 90.405 DBETA = .001
ALPHA= 83.761 DALPHA= .007
V=302.5
6. 18-0799
Mn0.66Si0.30Ni0.4
Triklin
Dexp Dcal d(D) h k l
3.9400 3.9385 .0015 1 0 3
2.3400 2.3408 -.0008 0 2 0
2.2200 2.2208 -.0008 3 0 5
2.1600 2.1600 .0000 -1 2 1
2.1100 2.1104 -.0004 2 2 2
2.0900 2.0886 .0014 2 -1 5
2.0400 2.0409 -.0009 2 -2 2
2.0200 2.0202 -.0002 -4 -1 1
1.9780 1.9790 -.0010 3 2 1
1.9380 1.9382 -.0002 -2 -1 4
1.8860 1.8882 -.0022 -2 1 4
1.7440 1.7447 -.0007 -4 0 3
A= 10.229 DA= .002
B= 4.6890 DB= .0009
C= 11.823 DC= .001
GAMMA= 86.90 DGAMMA= .02
BETA = 69.39 DBETA = .01
ALPHA= 89.67 DALPHA= .04
V=530.
7. 18-0879
NiMoO4
Triklin
Dexp Dcal d(D) h k l
6.1200 6.1257 -.0057 1 0 0
3.6600 3.6622 -.0022 -1 -1 1
3.4100 3.4117 -.0017 -1 0 1
3.0800 3.0815 -.0015 1 1 1
2.7280 2.7306 -.0026 1 0 2
2.3250 2.3259 -.0009 0 -2 2
2.1860 2.1870 -.0010 2 2 0
2.0610 2.0606 .0004 3 1 1
1.7090 1.7092 -.0002 -3 0 1
1.6210 1.6210 -.0000 4 1 1
1.6210 1.6210 -.0000 4 1 1
1.5970 1.5966 .0004 4 1 0
A= 6.5995 DA= .0005
B= 5.3053 DB= .0001
C= 5.945 DC= .001
GAMMA= 80.876 DGAMMA= .001
BETA = 75.602 DBETA = .002
ALPHA=112.806 DALPHA= .001
V=178.1
8. 18-0892
NiSO4*4H2O
Triklin
Dexp Dcal d(D) h k l
6.7400 6.7360 .0040 0 -1 1
6.3500 6.3271 .0229 -1 1 0
5.4200 5.4307 -.0107 0 -3 1
5.1000 5.1028 -.0028 -1 3 0
4.6900 4.6927 -.0027 -1 0 1
4.6400 4.6420 -.0020 -1 -1 1
4.5600 4.5641 -.0041 1 1 1
4.4300 4.4298 .0002 -1 -2 1
4.0800 4.0827 -.0027 0 -5 1
3.7800 3.7795 .0005 1 5 0
3.7800 3.7795 .0005 1 5 0
3.5700 3.5722 -.0022 0 -6 1
A= 6.513 DA= .004
B= 23.841 DB= .001
C= 6.8616 DC= .0002
GAMMA= 91.81 DGAMMA= .03
BETA = 89.36 DBETA = .07
ALPHA= 95.484 DALPHA= .006
V=1062.1
9. 18-0900
NiSO4Ti{SO4}2
Triklin
Dexp Dcal d(D) h k l
5.5000 5.5003 -.0003 0 1 1
4.7500 4.7494 .0006 -1 0 1
4.0500 4.0490 .0010 0 -1 1
3.7500 3.7476 .0024 1 0 1
3.2500 3.2478 .0022 1 -1 1
3.0000 3.0006 -.0006 2 0 0
2.5000 2.5001 -.0001 -2 -1 1
2.3200 2.3200 -.0000 2 1 1
2.1700 2.1708 -.0008 1 -1 2
2.1000 2.0991 .0009 -1 2 3
2.0000 2.0004 -.0004 3 0 0
1.9500 1.9508 -.0008 -1 3 3
A= 6.39327 DA= .00008
B= 8.3494 DB= .0003
C= 6.3733 DC= .0007
GAMMA=105.18 DGAMMA= .01
BETA =107.73 DBETA = .01
ALPHA= 68.671 DALPHA= .002
V= 297.4
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
5.5000 5.5017 -.0017 1 1 0
4.7500 4.7409 .0091 -1 0 1
4.0500 4.0493 .0007 1 1 1
3.7500 3.7562 -.0062 0 3 0
3.2500 3.2520 -.0020 0 0 2
3.0000 3.0001 -.0001 -1 0 2
2.5000 2.5012 -.0012 1 2 2
2.3200 2.3197 .0003 -2 1 2
2.1700 2.1695 .0005 2 0 2
2.1000 2.1005 -.0005 2 4 0
2.0000 2.0000 -.0000 1 5 1
1.9500 1.9498 .0002 3 0 1
a= 6.3289 b= 11.269 c= 6.529 beta= 95.06
da=.0003 db=.005 dc= .004 dbeta=.02
V= 463.8
10. 18-1050
K2Ni{SO4}2
Triklin
Dexp Dcal d(D) h k l
9.0800 9.0934 -.0134 0 1 0
6.6700 6.6809 -.0109 0 -1 2
6.5400 6.5339 .0061 1 0 1
5.5200 5.5209 -.0009 -1 -1 2
4.6600 4.6598 .0002 -1 -2 1
4.1200 4.1186 .0014 1 0 3
4.0500 4.0502 -.0002 1 2 1
3.9000 3.8986 .0014 0 -2 3
3.5800 3.5785 .0015 2 1 1
3.4900 3.4937 -.0037 1 2 2
3.3700 3.3715 -.0015 2 2 0
3.0600 3.0597 .0003 -1 -3 3
A= 7.602 DA= .003
B= 9.914 DB= .001
C= 15.475 DC= .002
GAMMA= 71.84 DGAMMA= .01
BETA = 94.12 DBETA = .01
ALPHA=105.66 DALPHA= .02
V= 1067
11. 18-1508
C20H22N2NiO4
Triklin
Dexp Dcal d(D) h k l
12.1000 12.0894 .0106 1 0 0
9.0900 9.0894 .0006 -1 1 0
8.0400 8.0548 -.0148 1 0 1
6.8900 6.8915 -.0015 1 1 0
6.6300 6.6299 .0001 -1 0 1
5.9700 5.9700 -.0000 1 -2 1
5.1100 5.1095 .0005 1 1 1
4.5200 4.5195 .0005 0 0 2
4.2100 4.2104 -.0004 -2 1 1
4.1900 4.1901 -.0001 -2 -1 1
3.9900 3.9900 -.0000 3 0 1
A= 13.423 DA= .006
B= 12.013 DB= .008
C= 10.5179 DC= .0007
GAMMA=113.19 DGAMMA= .04
BETA = 69.48 DBETA = .03
ALPHA=118.70 DALPHA= .04
V= 1339.9
12. 18-1627
C36H30As2Cl2NiO2
Triklin
Dexp Dcal d(D) h k l
9.3000 9.3681 -.0681 0 1 1
8.7000 8.7006 -.0006 0 -1 1
8.5000 8.4875 .0125 1 0 0
7.6000 7.6254 -.0254 1 1 1
6.8000 6.8139 -.0139 1 -1 1
6.2000 6.1915 .0085 0 2 1
6.0000 5.9977 .0023 -1 0 1
5.8000 5.8010 -.0010 0 -2 1
5.3200 5.3130 .0070 0 -1 2
5.1800 5.1844 -.0044 -1 2 0
5.0500 5.0438 .0062 1 -2 1
4.8000 4.8055 -.0055 1 2 2
A= 9.088 DA= .008
B= 13.99 DB= .01
C= 12.71 DC= .01
GAMMA= 83.9 DGAMMA= .1
BETA = 69.46 DBETA = .03
ALPHA= 83.9 DALPHA= .1
V= 1499.7
13. 18-1641
C14H12I2N4Ni
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
7.8700 7.8773 -.0073 1 1 0
7.1700 7.1700 .0001 1 1 1
4.8000 4.7942 .0058 2 1 1
4.7900 4.7942 -.0042 2 1 1
4.2100 4.2155 -.0055 1 2 2
4.0400 4.0400 .0000 1 1 3
3.8800 3.8820 -.0020 -1 2 2
3.6700 3.6719 -.0019 1 3 0
3.3900 3.3905 -.0005 3 1 0
3.2400 3.2394 .0006 3 1 2
3.1100 3.1117 -.0017 -2 0 3
3.0100 3.0078 .0022 -2 1 3
a=10.791 b= 11.74 c= 13.271 beta= 79.92
da=.003 db=.01 dc=.001 dbeta=.03
V= 1655.2
Triklin
Dexp Dcal d(D) h k l
7.8700 7.8688 .0012 0 1 0
7.1700 7.1683 .0017 -1 0 1
4.8000 4.7994 .0006 0 -1 2
4.7900 4.7913 -.0013 0 0 2
4.2100 4.2080 .0020 1 -2 1
4.0400 4.0383 .0017 -2 0 1
3.8800 3.8757 .0043 2 0 0
3.6700 3.6718 -.0018 2 -1 1
3.3900 3.3896 .0004 2 -2 1
3.2400 3.2409 -.0009 -1 -2 1
3.1100 3.1083 .0017 -1 -2 2
3.0100 3.0129 -.0029 2 1 0
A= 8.707 DA= .002
B= 8.8607 DB= .0004
C= 10.2733 DC= .0003
GAMMA=111.071 DGAMMA= .002
BETA =101.44 DBETA = .01
ALPHA=102.117 DALPHA= .001
V= 689.9
14. 18-1707
C6H10NiO2S4
Monoklin
GRUPA 3
Dexp. Dcal. d(D) h k l
10.4000 10.4005 -.0005 1 0 1
5.0600 5.0604 -.0004 -1 1 1
4.6800 4.6791 .0009 -1 1 2
4.1800 4.1802 -.0002 -1 1 3
3.7900 3.7902 -.0002 2 0 4
3.3200 3.3200 -.0000 -3 1 2
2.2800 2.2800 .0000 -5 1 3
a= 12.959 b= 5.6488 c= 20.2470 beta= 95.708
da=.0002 db=.0002 dc=.0009 dbet=.001
V=1474.7
15. 18-1720
C78H144N12S6*Ni{ClO4}2
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
8.6700 8.6580 .0120 1 1 0
6.1900 6.1887 .0013 1 1 1
4.8700 4.8713 -.0013 1 2 1
4.2000 4.2028 -.0028 1 0 2
4.0200 4.0175 .0025 1 1 2
3.7000 3.6994 .0006 -1 2 2
3.2100 3.2101 -.0001 0 4 1
2.7900 2.7901 -.0001 -2 0 3
2.5200 2.5200 .0000 3 4 0
a= 11.206 b= 13.679 c=9.328 beta= 93.66
da=.009 db=.009 dc=.001 dbeta=.05
V= 1427
16. 18-1722
C78H144N12S6*Ni{NO3}2
Rombik
Groupa 54
Dexp. Dcal. d(D) h k l
9.1700 9.5971 -.4271 0 1 0
5.8900 5.8855 .0045 1 1 1
4.6300 4.6286 .0014 2 1 1
4.2800 4.2937 -.0137 1 0 2
3.9300 3.9193 .0107 1 1 2
3.5500 3.5523 -.0023 2 2 1
3.2000 3.1997 .0003 1 2 2
3.0300 3.0299 .0001 3 2 1
2.8700 2.8694 .0006 2 3 0
a=12.98 b= 9.60 c= 9.10
da= .07 db= .01 dc= .03
V=1134
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
9.1700 9.1464 .0236 1 0 0
5.8900 5.8901 -.0001 1 1 0
4.6300 4.6172 .0128 0 1 1
4.2800 4.2804 -.0004 -2 0 1
3.9300 3.9319 -.0019 2 1 0
3.5500 3.5481 .0019 1 2 0
3.2000 3.2022 -.0022 0 2 1
3.0300 3.0313 -.0013 -1 0 2
2.8700 2.8698 .0002 -2 0 2
a= 9.611 b= 7.699 c= 6.063 beta= 107.88
da= .006 db=.003 dc=.003 dbeta=.09
V= 426.9
17. 18-1725
C22H14NiO4
Triklin
Dexp Dcal d(D) h k l
5.9300 5.9266 .0034 0 1 1
5.0300 5.0296 .0004 0 -1 1
4.5400 4.5409 -.0009 1 0 1
4.0300 4.0334 -.0034 -1 0 1
3.5800 3.5799 .0001 0 0 2
3.2900 3.2908 -.0008 1 2 0
3.1100 3.1097 .0003 1 1 2
2.8100 2.8101 -.0001 1 -1 2
2.5200 2.5197 .0003 -2 1 0
2.2700 2.2705 -.0005 2 0 2
1.9400 1.9401 -.0001 0 4 2
1.7900 1.7900 .0000 0 0 4
1.6600 1.6599 .0001 3 2 1
1.5800 1.5800 .0000 -1 5 0
A= 5.3530 DA= .0008
B= 8.42567 DB= .00009
C= 7.3180 DC= .0005
GAMMA= 88.105 DGAMMA= .007
BETA = 82.708 DBETA = .002
ALPHA= 80.379 DALPHA= .004
V= 322.7
18. 18-1759
C4H6NiO2S4
Rombik
Groupa 34,58
Dexp. Dcal. d(D) h k l
8.5000 8.5185 -.0185 1 0 1
6.2600 6.2644 -.0044 0 0 2
5.8000 5.8084 -.0084 2 0 0
5.2100 5.2261 -.0161 1 1 0
4.1300 4.1224 .0076 2 1 0
3.4000 3.3993 .0007 0 1 3
2.8700 2.8703 -.0003 3 1 2
a=11.62 b= 5.85 c=12.53
da= .01 db= .02 dc= .01
V= 852
19. 18-1764
C15H10NiO2*2H2O
Triklin
Dexp Dcal d(D) h k l
13.2000 13.1777 .0223 1 0 0
11.4000 11.4196 -.0196 0 1 0
10.3000 10.2983 .0017 1 0 1
7.9500 7.9402 .0098 0 -1 1
7.4300 7.4229 .0071 -1 0 1
6.6900 6.6897 .0003 2 0 1
5.9200 5.9042 .0158 -1 2 0
5.1000 5.0999 .0001 2 1 0
4.9900 4.9928 -.0028 0 -1 2
4.8200 4.8229 -.0029 3 -1 1
4.5700 4.5702 -.0002 -3 1 0
4.2500 4.2501 -.0001 -2 -1 1
A= 14.6037 DA= .0007
B= 11.988 DB= .001
C= 11.8307 DC= .0001
GAMMA=107.71 DGAMMA= .01
BETA = 70.6168 DBETA = .0006
ALPHA= 95.266 DALPHA= .004
V=1861.9
20. 18-1765
C16H14NiO4
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
5.3600 5.3598 .0002 2 1 0
4.8900 4.8812 .0088 -2 0 1
4.3900 4.3874 .0026 0 2 1
4.1100 4.1085 .0015 -1 2 1
3.8000 3.8008 -.0008 3 0 1
3.4500 3.4488 .0012 -3 1 1
3.2100 3.2096 .0004 -2 1 2
2.8600 2.8604 -.0004 4 1 1
2.7200 2.7175 .0025 1 0 3
2.5800 2.5802 -.0002 4 2 1
2.4900 2.4915 -.0015 2 1 3
2.4100 2.4102 -.0002 -2 1 3
a= 12.542610 b= 10.355 c= 8.273 beta= 87.26
da=.003 db=.002 dc=.006 dbeta=.05
V= 1073
Triklin
Dexp Dcal d(D) h k l
5.3600 5.3707 -.0107 0 1 1
4.8900 4.8886 .0014 0 -1 1
4.3900 4.3896 .0004 1 -1 1
4.1100 4.1146 -.0046 0 1 2
3.8000 3.7913 .0087 2 0 0
3.4500 3.4511 -.0011 0 0 3
3.2100 3.2152 -.0052 2 -1 1
2.8600 2.8606 -.0006 -1 2 1
2.7200 2.7169 .0031 1 -2 1
2.5800 2.5797 .0003 2 0 3
2.4900 2.4896 .0004 -2 2 1
2.4100 2.4081 .0019 -3 1 1
A= 7.671 DA= .001
B= 5.98272 DB= .00004
C= 10.416 DC= .003
GAMMA= 98.64 DGAMMA= .01
BETA = 89.7266 DBETA = .0001
ALPHA= 83.85 DALPHA= .01
V= 469.8
21. 18-1766
C16H14NiO4*2H2O
Triklin
Dexp Dcal d(D) h k l
9.1700 9.1387 .0313 0 1 1
7.5300 7.5285 .0015 0 -1 1
7.1300 7.1367 -.0067 -1 1 1
6.0200 6.0094 .0106 1 1 0
5.6200 5.6225 -.0025 -1 2 0
5.3500 5.3521 -.0021 -1 -1 1
4.6400 4.6401 -.0001 -1 2 2
4.4300 4.4347 -.0047 1 2 0
3.9100 3.9104 -.0004 1 1 2
3.7200 3.7202 -.0002 0 -3 1
3.5600 3.5597 .0003 1 -3 1
2.9300 2.9296 .0004 -2 -2 1
A= 8.179 DA= .001
B= 13.584 DB= .001
C= 11.252 DC= .005
GAMMA=106.363 DGAMMA= .007
BETA =103.629 DBETA = .002
ALPHA= 75.67 DALPHA= .02
V= 1143.5
22. 18-1767
C24H72N12O9P6*Ni{ClO4}
Triklin
Dexp Dcal d(D) h k l
10.8000 10.8092 -.0092 1 0 0
9.0200 9.0358 -.0158 0 1 0
7.1300 7.1303 -.0003 0 0 1
6.0200 6.0189 .0011 1 1 0
5.3700 5.3698 .0002 -1 1 1
4.7700 4.7696 .0004 -1 2 0
4.0900 4.0900 .0000 2 -1 1
3.8100 3.8101 -.0001 -3 1 0
3.0800 3.0800 .0000 2 1 1
2.8800 2.8800 .0000 -3 -1 2
A= 11.811 DA= .002
B= 9.807 DB= .002
C= 7.697 DC= .001
GAMMA=105.229 DGAMMA= .005
BETA =104.03 DBETA = .01
ALPHA=102.40 DALPHA= .01
V= 796.9
23. 18-1780
C10H20N4NiO4
Triklin
Dexp Dcal d(D) h k l
8.4900 8.4959 -.0059 1 0 0
7.8900 7.8800 .0100 0 1 1
7.7200 7.7242 -.0042 -1 0 1
6.7000 6.7102 -.0102 0 -1 1
6.0600 6.0587 .0013 -1 0 2
5.7000 5.7013 -.0013 1 0 2
5.4600 5.4606 -.0006 -1 -1 1
5.0900 5.0906 -.0006 1 -1 1
4.6100 4.6092 .0008 -1 -1 2
3.9600 3.9604 -.0004 0 1 4
3.7800 3.7799 .0001 2 1 1
3.6100 3.6095 .0005 1 -1 3
3.5400 3.5399 .0001 -1 2 2
A= 8.520 DA= .001
B= 8.241 DB= .001
C= 16.60583 DC= .00008
GAMMA= 87.415 DGAMMA= .007
BETA = 92.909 DBETA = .005
ALPHA= 78.62773 DALPHA= .00007
V=1139.6
18-1781
C10H20N4NiO4*4H2O
Triklin
Dexp Dcal d(D) h k l
9.5500 9.5607 -.0107 1 0 0
8.4900 8.5128 -.0228 1 -1 0
8.2200 8.2348 -.0148 0 0 1
5.9800 5.9682 .0118 1 -2 1
5.6300 5.6402 -.0102 2 -2 1
5.0600 5.0480 .0120 0 1 1
4.3600 4.3616 -.0016 1 1 1
4.2600 4.2564 .0036 -2 2 0
4.1200 4.1174 .0026 0 0 2
3.6800 3.6809 -.0009 1 -3 1
3.5700 3.5700 -.0000 2 1 0
3.5100 3.5100 .0000 3 -2 3
A= 13.262 DA= .005
B= 12.283 DB= .003
C= 11.162 DC= .004
GAMMA=130.37 DGAMMA= .03
BETA = 53.28 DBETA = .02
ALPHA=128.76 DALPHA= .02
V=1020.7
19. 18-1928
C16H40N2*Ni{CNO}4
Triklin
Dexp Dcal d(D) h k l
8.0800 8.0882 -.0082 1 0 0
7.1400 7.1593 -.0193 -1 1 0
6.2600 6.2655 -.0055 0 0 1
5.5700 5.5723 -.0023 1 1 0
5.0400 5.0329 .0071 -1 0 1
4.7200 4.7204 -.0004 -1 2 0
4.0700 4.0835 -.0135 1 1 1
3.9000 3.9002 -.0002 0 -2 1
3.7500 3.7505 -.0005 -1 2 1
3.5800 3.5796 .0004 -2 2 0
3.4400 3.4419 -.0019 2 1 0
3.3500 3.3487 .0013 2 0 1
A= 8.3555 DA= .0003
B= 10.0466 DB= .0004
C= 6.27052 DC= .00001
GAMMA=104.4212 DGAMMA= .0007
BETA = 91.472 DBETA = .001
ALPHA= 91.35154 DALPHA= .00002
V=509.2
20. 18-1939
C12h24N8S4*NiCl2
Triklin
Dexp Dcal d(D) h k l
7.7800 7.7754 .0046 1 0 0
7.3400 7.3291 .0109 0 1 1
5.9400 5.9481 -.0081 0 -1 1
5.0100 4.9997 .0103 -1 1 0
4.6800 4.6932 -.0132 1 0 2
4.3200 4.3233 -.0033 1 2 2
4.1700 4.1717 -.0017 2 2 1
4.0200 4.0205 -.0005 2 0 1
3.9000 3.8877 .0123 2 0 0
3.7400 3.7422 -.0022 2 2 0
3.6300 3.6249 .0051 -1 0 2
3.3900 3.3890 .0010 -1 -1 2
A= 9.21 DA= .01
B= 10.43 DB= .01
C= 10.621 DC= .001
GAMMA= 61.66 DGAMMA= .05
BETA = 66.24 DBETA = .05
ALPHA= 69.07 DALPHA= .06
V=804.8
21. 18-1967
C6H24N12S6*Ni{ClO4}2
Triklin
Dexp Dcal d(D) h k l
8.0000 7.9737 .0263 0 1 1
7.3200 7.3419 -.0219 -1 1 0
6.8300 6.8434 -.0134 0 -1 1
6.1600 6.1710 -.0110 1 -1 1
5.0200 5.0251 -.0051 0 -1 2
4.7700 4.7534 .0166 1 -1 2
4.3200 4.3201 -.0001 0 2 0
4.1200 4.1187 .0013 -1 2 2
3.9600 3.9603 -.0003 2 0 1
3.8300 3.8308 -.0008 0 -1 3
3.7100 3.7127 -.0027 1 -1 3
3.5700 3.5698 .0002 2 -1 2
A= 8.763 DA= .002
B= 9.3386 DB= .0007
C= 14.161 DC= .003
GAMMA=110.16 DGAMMA= .03
BETA = 92.70 DBETA = .03
ALPHA= 79.92 DALPHA= .01
V= 1071.0
22. 18-1989
C33H30AsNiS8
Triklin
Dexp Dcal d(D) h k l
9.3100 9.3201 -.0101 1 0 0
8.5900 8.5808 .0092 0 1 1
7.7000 7.7062 -.0062 -1 0 1
7.1300 7.1486 -.0186 1 0 1
6.8200 6.8474 -.0274 0 -1 1
5.8700 5.8748 -.0048 -1 1 1
5.3000 5.3037 -.0037 -1 0 2
5.0400 5.0348 .0052 1 -1 1
4.7500 4.7467 .0033 1 2 1
4.7000 4.6997 .0003 0 -1 2
4.5300 4.5262 .0038 -1 -1 2
4.2900 4.2904 -.0004 0 2 2
A= 9.593 DA= .001
B= 10.159 DB= .006
C= 12.560 DC= .007
GAMMA= 77.03 DGAMMA= .04
BETA = 91.46 DBETA = .02
ALPHA= 77.50 DALPHA= .01
V= 1161.0
23. 19-1587
C12H30Cl2N4Ni
Triklin
Dexp Dcal d(D) h k l
7.6200 7.6197 .0003 1 0 0
6.8300 6.8218 .0082 0 0 1
5.9300 5.9277 .0023 1 0 1
3.9900 3.9894 .0006 0 -2 1
3.1900 3.1911 -.0011 1 -2 1
2.9000 2.9005 -.0005 1 -2 2
2.7600 2.7615 -.0015 3 1 0
2.6900 2.6857 .0043 3 1 1
2.6100 2.6095 .0005 -2 -2 2
2.5400 2.5399 .0001 3 0 0
2.4400 2.4396 .0004 2 -2 1
2.3400 2.3408 -.0008 1 -2 3
A= 8.357 DA= .007
B= 8.505 DB= .002
C= 7.566 DC= .003
GAMMA= 71.08 DGAMMA= .02
BETA = 83.04 DBETA = .08
ALPHA=110.70 DALPHA= .09
V= 458.7
23. 19-1848
C22H28N2NiO6
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
9.2600 9.2741 -.0141 1 1 0
7.3500 7.3452 .0048 1 1 1
6.6700 6.6666 .0034 0 0 2
6.3100 6.3311 -.0211 0 2 1
4.8000 4.7959 .0041 0 3 0
4.4600 4.4599 .0001 1 3 0
4.1800 4.1819 -.0019 1 3 1
3.8900 3.8895 .0005 1 1 3
3.6400 3.6401 -.0001 3 1 1
3.3700 3.3704 -.0004 -2 3 2
3.0500 3.0495 .0005 -2 4 1
2.6000 2.6000 .0000 3 4 1
2.2500 2.2500 .0000 -4 2 4
2.2100 2.2100 .0000 2 4 4
a= 12.1962 b= 14.387 c= 13.405 beta= 95.95
da=.0006 db=.008 dc=.002 dbeta=.01
V= 2340
Triklin
Dexp Dcal d(D) h k l
9.2600 9.2588 .0012 1 0 0
7.3500 7.3397 .0103 -1 1 0
6.6700 6.6772 -.0072 0 0 1
6.3100 6.2985 .0115 0 -1 1
4.8000 4.8040 -.0040 -1 1 1
4.4600 4.4669 -.0069 0 -2 1
4.1800 4.1815 -.0015 -2 0 1
3.8900 3.8907 -.0007 2 1 0
3.6400 3.6411 -.0011 2 -1 1
3.3700 3.3682 .0018 -1 -1 2
3.0500 3.0487 .0013 2 2 0
2.6000 2.5999 .0001 3 -2 1
2.2500 2.2498 .0002 -4 2 0
2.2100 2.2101 -.0001 -4 -1 1
A= 9.516 DA= .002
B= 9.955 DB= .009
C= 6.993 DC= .002
GAMMA= 98.19 DGAMMA= .02
BETA = 98.229 DBETA = .006
ALPHA=103.734 DALPHA= .001
V= 626.11
24. 19-1864
C18H14N4NiO6
Triklin
Dexp Dcal d(D) h k l
7.0700 7.0721 -.0021 1 0 0
5.4300 5.4198 .0102 1 -1 0
4.6300 4.6287 .0013 1 -1 1
4.0000 4.0042 -.0042 1 1 1
8.9100 8.9100 -.0000 0 0 1
3.6600 3.6622 -.0022 -2 1 0
3.2700 3.2697 .0003 -1 0 2
2.7400 2.7395 .0005 2 1 2
2.5400 2.5394 .0006 -3 1 0
2.4200 2.4200 -.0000 1 2 1
2.1100 2.1101 -.0001 3 -2 2
2.0300 2.0300 .0000 0 2 4
1.9400 1.9399 .0001 -2 3 1
A= 7.97694 DA= .00007
B= 5.9807 DB= .0002
C= 9.7091 DC= .006
GAMMA=107.79 DGAMMA= .04
BETA = 73.093 DBETA = .008
ALPHA= 80.30 DALPHA= .08
V= 404.8
25. 19-1891
C24H36N5NiS4
Triklin
Dexp Dcal d(D) h k l
13.4000 13.3545 .0455 1 0 0
10.8000 10.8104 -.0104 0 1 0
9.8100 9.7808 .0292 1 0 1
9.5100 9.4756 .0344 0 -1 1
7.9000 7.9030 -.0030 1 1 0
7.2000 7.1758 .0242 2 -1 1
6.9200 6.9162 .0038 -1 0 1
6.6500 6.6772 -.0272 2 0 0
6.5100 6.4797 .0303 -1 -1 1
5.8300 5.8404 -.0104 0 -2 1
5.4300 5.4307 -.0007 2 -2 1
5.3100 5.3117 -.0017 1 0 2
A= 15.028 DA= .009
B= 12.466 DB= .006
C= 12.145 DC= .008
GAMMA=108.61 DGAMMA= .04
BETA = 63.725 DBETA = .006
ALPHA=118.96 DALPHA= .08
V= 1769.1
26. 19-1903
C38H44NNiS4
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
9.4400 9.4220 .0180 1 1 0
8.3500 8.3171 .0329 1 0 1
7.7700 7.7773 -.0073 0 1 1
6.8600 6.9060 -.0460 1 1 1
6.2400 6.2592 -.0192 2 1 0
5.2700 5.2656 .0044 0 2 1
4.8400 4.8348 .0052 3 0 0
4.2900 4.2858 .0042 2 2 1
4.0700 4.0698 .0002 -2 0 2
3.8100 3.8118 -.0018 3 2 0
3.5400 3.5399 .0001 -3 2 1
a= 14.508 b= 12.39 c= 9.992 beta= 88.67
da=.004 db= 3.13 dc=.008 dbeta=.06
V= 1796
Triklin
Dexp Dcal d(D) h k l
9.4400 9.4510 -.0110 1 0 0
8.3500 8.3590 -.0090 0 1 0
7.7700 7.7794 -.0094 0 0 1
6.8600 6.8623 -.0023 -1 0 1
6.2400 6.2438 -.0038 0 -1 1
5.2700 5.2690 .0010 0 1 1
4.8400 4.8398 .0002 1 -1 1
4.2900 4.2899 .0001 1 1 1
4.0700 4.0699 .0001 2 1 0
3.8100 3.8096 .0004 -1 -1 2
3.5400 3.5398 .0002 1 -2 1
A= 9.733 DA= .002
B= 8.481 DB= .002
C= 8.1250 DC= .0007
GAMMA= 89.11 DGAMMA= .01
BETA =103.752 DBETA = .005
ALPHA= 99.646 DALPHA= .001
V= 642.08
27. 19-1904
C38H36Cl8NNiS4
Triklin
Dexp Dcal d(D) h k l
12.4000 12.3348 .0652 1 0 0
11.7000 11.6863 .0137 0 1 0
8.7500 8.7375 .0125 0 0 1
7.8700 7.8453 .0247 1 1 0
7.2000 7.1907 .0093 1 0 1
6.1700 6.1674 .0026 2 0 0
5.6000 5.5992 .0008 1 -2 1
5.0800 5.0815 -.0015 2 0 1
4.3700 4.3687 .0013 0 0 2
4.1400 4.1414 -.0014 1 0 2
4.0500 4.0503 -.0003 0 -3 1
3.9100 3.9099 .0001 -1 3 0
3.5000 3.5005 -.0005 -3 -1 1
3.2100 3.2102 -.0002 0 3 1
A= 12.551 DA= .004
B= 12.4926 DB= .0002
C= 9.207 DC= .001
GAMMA=100.61 DGAMMA= .02
BETA = 85.73 DBETA = .02
ALPHA=108.3476 DALPHA= .0007
V= 1346.6
28. 19-1905
C36H60NNiS4
Triklin
Dexp Dcal d(D) h k l
12.7000 12.8112 -.1112 1 0 0
11.8000 11.7473 .0527 0 1 0
8.6600 8.6364 .0236 0 0 1
7.9600 7.9894 -.0294 -1 1 0
7.6100 7.6114 -.0014 0 -1 1
7.2800 7.2667 .0133 -1 0 1
6.1100 6.0899 .0201 2 1 0
5.6000 5.5986 .0014 -1 1 1
5.2700 5.2812 -.0112 -2 -1 1
5.0700 5.0699 .0001 2 0 1
4.3900 4.3876 .0024 -2 1 1
4.1300 4.1311 -.0011 -1 0 2
3.9100 3.9113 -.0013 2 2 1
3.4900 3.4903 -.0003 1 -3 1
3.2200 3.2195 .0005 -1 -3 2
A= 13.0382 DA= .0005
B= 12.1307 DB= .0003
C= 8.7847 DC= .0001
GAMMA= 79.4450 DGAMMA= .0003
BETA = 93.628 DBETA = .001
ALPHA=100.401 DALPHA= .001
V=1343
29. 19-1906
C32H52NNiS4
Triklin
Dexp Dcal d(D) h k l
11.4000 11.3453 .0547 1 0 0
8.3500 8.3693 -.0193 0 1 0
8.0200 8.0278 -.0078 0 1 1
7.6900 7.6906 -.0006 1 1 0
7.0800 7.0680 .0120 1 0 1
6.5500 6.5474 .0026 -1 0 1
4.9000 4.8988 .0012 2 0 1
4.6800 4.6786 .0014 0 2 1
4.2800 4.2796 .0004 1 2 0
3.9200 3.9205 -.0005 3 1 1
3.5600 3.5604 -.0004 2 -1 1
3.1400 3.1401 -.0001 0 1 3
A= 11.9882 DA= .0001
B= 9.868 DB= .001
C= 9.729 DC= .001
GAMMA= 71.70 DGAMMA= .01
BETA = 77.39 DBETA = .01
ALPHA= 60.99 DALPHA= .01
V=952.2
30. 19-1938
C36H20AsCl8NiS4
Triklin
Dexp Dcal d(D) h k l
11.0000 10.9868 .0132 1 0 0
10.1000 10.1206 -.0206 0 1 0
9.4600 9.4282 .0318 0 0 1
8.2500 8.3373 -.0873 1 0 1
7.1300 7.1273 .0027 -1 1 0
6.3500 6.3537 -.0037 0 -1 1
5.4300 5.4160 .0140 2 0 1
5.0200 5.0237 -.0037 2 1 0
4.7900 4.7894 .0006 1 1 2
4.4300 4.4329 -.0029 2 -1 1
4.1600 4.1588 .0012 0 -2 1
4.0200 4.0191 .0009 1 -1 2
3.8500 3.8500 -.0000 -1 1 2
3.4100 3.4099 .0001 3 1 2
3.2600 3.2601 -.0001 1 0 3
A= 11.52377 DA= .00008
B= 10.3995 DB= .0001
C= 10.0101 DC= .0002
GAMMA= 81.583 DGAMMA= .002
BETA = 73.218 DBETA = .001
ALPHA= 77.759 DALPHA= .002
V=1117.7
31. 19-1962
C12H36Cl2N4NiO12
romb.
Grupa 26,28,51
Dexp. Dcal. d(D) h k l
8.8000 8.8700 -.0700 1 0 0
5.1500 5.1395 .0105 1 0 1
4.5900 4.5880 .0020 0 3 0
4.2100 4.2213 -.0113 2 1 0
3.7300 3.7279 .0021 2 2 0
3.1500 3.1530 -.0030 0 0 2
a= 8.87 b=13.764 c= 6.306
da= .01 db= .001 dc= .001
v= 769.88
32. 20-1779
C6H18N4NiO4
Rombik
Groupa 27
Dexp. Dcal. d(D) h k l
8.2178 8.2000 .0178 0 1 0
5.7143 5.8100 -.0957 1 0 0
4.7536 4.7406 .0130 1 1 0
3.2518 3.2500 .0018 0 0 2
1.9905 1.9907 -.0002 2 3 0
a= 5.810 b= 8.200 c= 6.500
da= .001 db= .001 dc= .001000
V= 309.7