1. 48-0050
Bi13.1Ca5.0Sr11.3Y3.5Cu12.9Ox
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
15.6020 15.3959 .2061 0 0 1
7.6890 7.6980 -.0090 0 0 2
5.1100 5.1183 -.0083 1 1 0
3.8540 3.8490 .0050 0 0 4
3.8210 3.8175 .0035 0 1 3
3.6080 3.6078 .0002 -3 0 2
3.2600 3.2609 -.0009 -3 0 3
3.0790 3.0792 -.0002 0 0 5
3.0500 3.0503 -.0003 -3 1 2
2.8880 2.8904 -.0024 -3 0 4
2.7170 2.7153 .0017 1 2 1
2.5660 2.5660 .0000 0 0 6
a= 11.606 b= 5.7119 c= 15.498 beta= 96.58
da= .001 db= .0001 dc= .006 dbeta=.01
V= 1020.6
Triklin
Dexp Dcal d(D) h k l
15.6020 15.7183 -.1163 0 1 0
7.6890 7.6896 -.0006 0 0 1
5.1100 5.1110 -.0010 0 -2 1
3.8540 3.8576 -.0036 1 0 0
3.8210 3.8265 -.0055 -1 1 0
3.6080 3.6067 .0013 0 -1 2
3.2600 3.2583 .0017 0 -2 2
3.0790 3.0778 .0012 -1 -1 1
3.0500 3.0487 .0013 1 -3 1
2.8880 2.8848 .0032 -1 4 0
2.7170 2.7160 .0010 1 -4 1
2.5660 2.5632 .0028 0 0 3
A= 3.927 DA= .002
B= 15.947 DB= .002
C= 7.893 DC= .006
GAMMA= 93.66 DGAMMA= .04
BETA = 80.53 DBETA = .05
ALPHA= 81.75 DALPHA= .01
V= 480.5
2. 48-0481
YBa8Cu4{CO3}0.2O11.06
Tetragon
Groupa 105,112,131
Dexp. Dcal. d(D) h k l
8.0700 8.0833 -.0133 0 0 1
4.0700 4.0728 -.0028 1 0 0
4.0400 4.0417 -.0017 0 0 2
2.8700 2.8688 .0012 1 0 2
2.3490 2.3454 .0036 1 1 2
2.2470 2.2472 -.0002 1 0 3
2.0350 2.0364 -.0014 2 0 0
2.0190 2.0208 -.0018 0 0 4
1.8200 1.8214 -.0014 2 1 0
1.6620 1.6606 .0014 2 1 2
1.6590 1.6606 -.0016 2 1 2
1.5100 1.5090 .0010 2 1 3
a= 4.0728 c= 8.083
da= .0001 dc= .001
V= 134.08
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
8.0700 8.0759 -.0059 1 0 0
4.0700 4.0688 .0012 1 1 0
4.0400 4.0380 .0020 2 0 0
2.8700 2.8688 .0012 -3 0 2
2.3490 2.3493 -.0003 2 1 2
2.2470 2.2464 .0006 0 1 4
2.0350 2.0344 .0006 2 2 0
2.0190 2.0190 .0000 4 0 0
1.8200 1.8197 .0003 -4 0 5
1.6620 1.6624 -.0004 -3 2 4
1.6590 1.6592 -.0002 -3 1 6
1.5100 1.5101 -.0001 5 0 1
a= 8.718 b= 4.71023 c= 11.036 beta= 112.13
da= .007 db=.00008 dc=.006 dbeta=.08
V= 419.8
3. 48-0482
Y1.33Ba8Cu4{CO3}0.2O12.62
Rombik
Grupa 17
Dexp. Dcal. d(D) h k l
8.0300 8.0651 -.0351 0 1 0
4.1000 4.0842 .0158 0 0 3
4.0300 4.0325 -.0025 0 2 0
2.8760 2.8818 -.0058 1 2 2
2.8580 2.8636 -.0056 0 1 4
2.3440 2.3447 -.0007 0 1 5
2.2450 2.2455 -.0005 0 3 3
2.0550 2.0600 -.0050 2 0 4
2.0210 2.0205 .0005 0 3 4
2.0160 2.0163 -.0003 0 4 0
1.8350 1.8347 .0003 3 0 1
1.8120 1.8110 .0010 0 3 5
a= 5.567 b= 8.065 c=12.25
da= .009 db= .001224 dc= .01
v= 550.1
Triklin
Dexp Dcal d(D) h k l
8.0300 8.0310 -.0010 1 0 0
4.1000 4.0973 .0027 -1 1 1
4.0300 4.0319 -.0019 -1 -1 1
2.8760 2.8749 .0011 2 0 1
2.8580 2.8585 -.0005 2 2 0
2.3440 2.3443 -.0003 1 1 2
2.2450 2.2439 .0011 0 2 2
2.0550 2.0551 -.0001 -3 1 2
2.0210 2.0212 -.0002 4 1 0
2.0160 2.0160 .0000 -2 -2 2
1.8350 1.8348 .0002 -3 -3 1
1.8120 1.8119 .0001 -3 2 2
A= 8.3789 DA= .0007
B= 6.9939 DB= .0005
C= 5.5014 DC= .0006
GAMMA= 81.824 DGAMMA= .002
BETA =103.485 DBETA = .004
ALPHA= 84.767 DALPHA= .001
V= 307.7
4. 48-0483
YBa8Cu4.33{CO3}0.2O12.52
Rombik
Groupa 17
Dexp. Dcal. d(D) h k l
8.0400 8.0800 -.0400 0 1 0
4.0900 4.1003 -.0103 0 0 1
4.0400 4.0400 .0000 0 2 0
2.8770 2.8778 -.0008 0 2 1
2.8590 2.8600 -.0010 1 2 0
2.3440 2.3457 -.0017 1 2 1
2.2440 2.2426 .0014 1 3 0
2.0500 2.0501 -.0001 0 0 2
2.0200 2.0200 .0000 0 4 0
1.8300 1.8291 .0009 1 0 2
1.8100 1.8101 -.0001 2 2 0
1.6660 1.6663 -.0003 1 2 2
1.6540 1.6540 .0000 1 4 1
a= 4.049 b= 8.080 c= 4.100
da= .001 db= .004 dc= .003
v= 134.1
5. 48-0648
K7{Ca{H2O}CuW11.039}*11H2O
Rombik
Groupa 16
Dexp. Dcal. d(D) h k l
10.8000 10.7690 .0310 0 1 0
9.8170 9.7328 .0842 1 0 0
5.3870 5.3845 .0025 0 2 0
4.8170 4.8023 .0147 0 1 1
3.1050 3.1064 -.0014 3 1 0
2.9830 2.9835 -.0005 0 3 1
2.6890 2.6883 .0007 3 1 1
2.6030 2.6031 -.0001 0 1 2
a= 9.7328 b=10.769 c= 5.365
da= .0007 db= .003 dc= .003
V= 562.4
6. 48-0682
Na4Cu0.65Mn0.35Ox
Rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
4.4390 4.4328 .0062 1 1 1
3.8710 3.8781 -.0071 0 0 2
3.6840 3.6764 .0076 2 0 0
2.5300 2.5298 .0002 2 1 2
2.4480 2.4509 -.0029 3 0 0
2.3380 2.3370 .0010 3 0 1
2.1530 2.1520 .0010 2 3 0
1.9210 1.9215 -.0005 1 4 0
1.8750 1.8750 .0000 1 0 4
a= 7.3528 b= 7.963 c= 7.756
da= .0002 db= .005 dc= .001
V= 454.1
7. 48-0683
Na4Cu0.65Mn0.35Ox
Monoklin
GRUPA 3
Dexp. Dcal. d(D) h k l
5.5880 5.5987 -.0107 -1 1 1
3.8850 3.8898 -.0048 0 0 3
3.4160 3.4262 -.0102 2 1 0
3.2340 3.2360 -.0020 1 1 3
2.9740 2.9768 -.0028 2 2 1
2.7920 2.7994 -.0074 -2 2 2
2.7090 2.7122 -.0032 -1 3 3
2.6070 2.6080 -.0010 1 4 2
2.5280 2.5282 -.0002 0 5 1
2.4170 2.4170 -.0000 0 3 4
2.3660 2.3671 -.0011 0 5 2
2.3180 2.3179 .0001 -1 3 4
a= 7.11 b= 12.949 c= 11.684 beta= 92.87
da= .01 db=.002 dc=.002 dbet=.01
V=1072.5
Triklin
Dexp Dcal d(D) h k l
5.5880 5.5856 .0024 0 1 0
3.8850 3.8854 -.0004 -1 -1 1
3.4160 3.4143 .0017 0 -1 2
3.2340 3.2345 -.0005 2 1 1
3.0390 3.0399 -.0009 -2 -1 1
2.9740 2.9728 .0012 -1 -1 2
2.7920 2.7928 -.0008 0 2 0
2.7090 2.7071 .0019 0 -2 1
2.6070 2.6058 .0012 3 1 1
2.5280 2.5277 .0003 -4 1 0
2.4170 2.4171 -.0001 4 -1 2
2.3660 2.3643 .0017 0 1 3
A= 10.664 DA= .003
B= 5.7772 DB= .0007
C= 8.360 DC= .005
GAMMA=104.12 DGAMMA= .02
BETA = 77.02 DBETA = .01
ALPHA= 97.414 DALPHA= .003
V= 485.2
8. 48-0781
K8Zn{H2O}CuW11O39*11H2O
Triklin
Dexp Dcal d(D) h k l
10.6950 10.6606 .0344 -1 1 0
9.9270 9.9282 -.0012 1 1 0
9.4200 9.4204 -.0004 0 0 1
5.5620 5.5605 .0015 2 0 1
5.3290 5.3303 -.0013 -2 2 0
4.9670 4.9641 .0029 2 2 0
4.7970 4.7945 .0025 2 2 1
3.2040 3.2044 -.0004 3 2 2
3.1400 3.1401 -.0001 -3 4 0
3.0910 3.0911 -.0001 -2 5 1
2.9950 2.9971 -.0021 0 -5 1
2.9320 2.9310 .0010 -4 2 1
2.8340 2.8340 .0000 0 4 3
2.5910 2.5911 -.0001 2 6 1
A= 12.974 DA= .006
B= 17.428 DB= .003
C= 9.675 DC= .005
GAMMA= 93.21 DGAMMA= .01
BETA = 85.65 DBETA = .04
ALPHA= 77.862 DALPHA= .009
V=2128.2
9. 48-0782
K8Cd{H2O}CuW11O39*9H2O
Triklin
Dexp Dcal d(D) h k l
9.7820 9.8163 -.0343 -1 1 0
8.9880 8.9226 .0654 1 1 0
5.4710 5.4706 .0004 2 1 0
4.9390 4.9299 .0091 -1 -1 1
4.6030 4.6004 .0026 -1 3 0
4.2060 4.2042 .0018 0 3 1
3.5790 3.5780 .0010 0 4 0
3.4040 3.4050 -.0010 -2 -2 1
3.3710 3.3727 -.0017 0 4 1
3.3050 3.3055 -.0005 1 -1 2
3.1870 3.1862 .0008 -1 1 2
2.8490 2.8492 -.0002 -1 5 0
A= 12.59 DA= .02
B= 14.4904 DB= .0006
C= 7.063 DC= .001
GAMMA= 94.09 DGAMMA= .01
BETA = 79.44 DBETA = .06
ALPHA= 82.884 DALPHA= .009
V=1254.2
10. 48-0785
{CuI}0.55*{Ag2MoO4}0.45
Triklin
Dexp Dcal d(D) h k l
4.5000 4.4990 .0010 0 1 0
4.2700 4.2693 .0007 -1 -1 1
3.9100 3.9105 -.0005 0 -1 2
3.1600 3.1583 .0017 -1 -1 3
2.7100 2.7100 .0000 0 -1 4
2.6400 2.6399 .0001 -1 -1 4
2.5100 2.5101 -.0001 -1 -2 1
2.4400 2.4407 -.0007 2 0 0
2.3500 2.3503 -.0003 1 1 4
2.2500 2.2495 .0005 0 2 0
1.9800 1.9801 -.0001 1 2 3
1.6700 1.6699 .0001 3 2 1
1.5300 1.5299 .0001 2 -1 5
1.4300 1.4300 -.0000 1 -2 6
A= 5.3957 DA= .0008
B= 5.0316 DB= .0003
C= 12.243 DC= .001
GAMMA= 64.838 DGAMMA= .005
BETA = 92.32 DBETA = .02
ALPHA= 99.05582 DALPHA= .01704
V= 296.9
11. 48-0786
{CuI}0.3*{Ag2MoO4}0.7
Rombik
Groupa 48
Dexp. Dcal. d(D) h k l
3.7700 3.7872 -.0172 0 0 2
3.6300 3.6338 -.0038 0 1 1
3.2200 3.2227 -.0027 3 0 1
3.0900 3.0895 .0005 2 0 2
2.7000 2.7001 -.0001 3 1 0
2.4600 2.4571 .0029 1 0 3
2.2000 2.1986 .0014 3 1 2
2.0700 2.0708 -.0008 0 2 0
1.9000 1.8988 .0012 5 1 0
1.6400 1.6391 .0009 2 1 4
1.6300 1.6310 -.0010 5 0 3
1.4100 1.4103 -.0003 1 1 5
a=10.683 b= 4.1415 c= 7.574
da= .004 db= .0006 dc= .002
V= 335.1
12. 48-0787
{CuI}0.2{Ag2MoO4}0.8
Rombik
Groupa 32,55
Dexp. Dcal. d(D) h k l
3.7700 3.7634 .0066 1 1 0
3.6400 3.6460 -.0060 0 0 3
3.2200 3.2133 .0067 2 1 0
3.0800 3.0830 -.0030 2 1 1
2.6700 2.6671 .0029 3 1 0
2.1900 2.1876 .0024 0 0 5
2.0600 2.0618 -.0018 4 1 2
1.9000 1.8999 .0001 4 1 3
1.6400 1.6407 -.0007 1 1 6
1.6200 1.6197 .0003 0 2 4
1.4800 1.4802 -.0002 0 2 5
1.4000 1.3996 .0004 6 1 4
a=10.692 b= 4.02067 c=10.938
da= .009 db= .00003 dc= .008
V= 470.2
13. 48-0825
Cu3.5O4{OH}4*2H2O
Triklin
Dexp Dcal d(D) h k l
10.7100 10.6899 .0201 0 1 0
5.3890 5.3974 -.0084 -1 0 1
5.1550 5.1480 .0070 1 -1 1
4.4070 4.4010 .0060 1 -2 1
4.1250 4.1211 .0039 2 0 0
3.9170 3.9174 -.0004 -1 -2 1
3.5200 3.5206 -.0006 -2 1 1
3.3510 3.3519 -.0009 2 0 1
3.1700 3.1685 .0015 -1 -1 2
2.9590 2.9593 -.0003 1 0 2
2.8940 2.8948 -.0008 -1 3 1
2.7930 2.7963 -.0033 0 -3 2
A= 8.468 DA= .003
B= 11.304 DB= .001
C= 6.806 DC= .001
GAMMA=102.13 DGAMMA= .04
BETA = 92.294 DBETA = .003
ALPHA=103.872 DALPHA= .001
V= 616.05
14. 48-0862
BaCuO2.36
Triklin
Dexp Dcal d(D) h k l
5.1450 5.1443 .0007 -1 0 1
4.8670 4.8641 .0029 0 1 1
4.4460 4.4456 .0004 0 -1 1
4.2270 4.2259 .0011 1 -1 1
3.9760 3.9756 .0004 0 2 0
3.8820 3.8843 -.0023 -2 0 1
3.2320 3.2286 .0034 3 0 0
3.1820 3.1804 .0016 1 -2 1
3.1060 3.1045 .0015 -2 -1 1
3.0240 3.0238 .0002 2 1 1
2.6920 2.6920 .0000 3 1 0
2.5720 2.5721 -.0001 -2 0 2
A= 10.385 DA= .002
B= 8.52353 DB= .00004
C= 5.796 DC= .002
GAMMA=110.444 DGAMMA= .008
BETA = 97.880 DBETA = .003
ALPHA= 82.21 DALPHA= .02
V=474.3
15. 48-0874
K2CuSO4Br2
Geksagon
Groupa 184, 192
Dexp. Dcal. d(D) h k l
8.1100 8.2477 -.1377 1 0 0
3.1200 3.1173 .0027 2 1 0
2.8800 2.8798 .0002 0 0 2
2.2000 2.2003 -.0003 2 2 1
a= 9.524 c= 5.7596
da=.004 dc=.0002
V= 452.4
16. 48-0985
AgCaSr2Bi2Cu2OxI2
Rombik
Groupa 54
Dexp. Dcal. d(D) h k l
23.1720 22.8532 .3188 0 1 0
11.4870 11.4266 .0604 0 2 0
7.6421 7.6177 .0244 0 3 0
5.7269 5.7133 .0136 0 4 0
4.5788 4.5706 .0082 0 5 0
3.8130 3.8089 .0041 0 6 0
3.2676 3.2647 .0029 0 7 0
2.8581 2.8566 .0015 0 8 0
2.5405 2.5392 .0013 0 9 0
2.2856 2.2853 .0003 0 10 0
2.0778 2.0776 .0002 0 11 0
1.9043 1.9044 -.0001 0 12 0
1.7575 1.7579 -.0004 0 13 0
1.6232 1.6229 .0003 3 5 2
1.5224 1.5225 -.0001 3 10 1
1.4266 1.4268 -.0002 2 12 2
a= 6.558 b=22.85 c= 5.714
da= .006 db= .01 dc= .004
v= 856.3
17. 48-1044
C2H2CuO4
Rombik
Groupa 32, 55
Dexp. Dcal. d(D) h k l
4.9000 4.9000 .0000 0 0 1
4.6000 4.6175 -.0175 1 1 0
4.2900 4.2875 .0025 0 2 0
2.6100 2.6099 .0001 2 1 0
a= 5.480 b= 8.575 c= 4.900
da= .001 db= .005 dc= .001
V= 230.2
18. 48-1045
C6H6Ca2CuO12
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
6.0800 6.0842 -.0042 2 1 0
5.6600 5.6645 -.0045 -2 0 1
4.5100 4.5101 -.0001 2 0 2
3.9400 3.9384 .0016 -3 1 1
3.5900 3.5902 -.0002 -3 2 1
3.0900 3.0901 -.0001 -4 1 1
2.8500 2.8500 .0000 -3 3 2
2.4600 2.4600 .0000 4 4 1
2.0200 2.0200 .0000 5 0 4
a= 13.3073 b= 15.1253 c= 11.750 beta= 87.17
da=.0003 db= .0001 dc= .002 dbeta=.01
V= 2362.1
19. 48-1054
C2CuO4*H2O
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
4.2600 4.2599 .0001 1 1 0
3.8600 3.8599 .0001 -1 1 1
3.1300 3.1310 -.0010 1 1 2
2.8600 2.8587 .0013 1 0 3
2.4900 2.4901 -.0001 -3 0 1
2.3100 2.3098 .0002 3 1 0
2.1400 2.1395 .0005 -1 2 2
1.7800 1.7803 -.0003 -3 2 1
1.7300 1.7300 -.0000 0 1 5
a= 7.7754 b= 5.0923 c= 9.197 beta= 89.600
da= .0004 db=.0006 dc= .01 dbeta=.005
V= 364.2
20. 48-1056
C2Ba0.58Cu0.42O4*4H2O
Triklin
Dexp Dcal d(D) h k l
6.2770 6.2572 .0198 2 2 0
5.8990 5.9098 -.0108 1 0 1
5.5770 5.5671 .0099 1 3 0
5.3400 5.3474 -.0074 -1 2 1
4.5190 4.5186 .0004 2 2 1
4.2490 4.2513 -.0023 1 -2 1
3.9690 3.9712 -.0022 0 4 0
3.7730 3.7702 .0028 1 4 1
3.4710 3.4741 -.0031 -4 0 1
3.1850 3.1870 -.0020 0 -2 2
2.9670 2.9653 .0017 1 -4 1
2.6840 2.6844 -.0004 1 6 1
A= 14.831 DA= .004
B= 16.789 DB= .006
C= 7.713 DC= .004
GAMMA= 73.080 DGAMMA= .006
BETA =103.27 DBETA = .05
ALPHA= 85.93 DALPHA= .04
V=1769.0
21. 48-1187
{Cu{NH3}2}{NO3}2
Triklin
Dexp Dcal d(D) h k l
6.9050 6.8899 .0151 1 1 0
5.7980 5.7991 -.0011 0 1 1
5.1960 5.2060 -.0100 0 -1 1
4.8720 4.8752 -.0032 2 0 1
4.5350 4.5414 -.0064 1 -1 1
4.1530 4.1572 -.0042 0 0 2
4.0690 4.0669 .0021 1 1 2
3.7310 3.7332 -.0022 1 2 1
3.5310 3.5298 .0012 2 2 1
3.4550 3.4530 .0020 3 1 0
3.1240 3.1260 -.0020 1 2 2
3.0850 3.0833 .0017 2 2 2
A= 10.995 DA= .005
B= 7.717 DB= .008
C= 8.715 DC= .002
GAMMA= 71.70 DGAMMA= .03
BETA = 73.69 DBETA = .02
ALPHA= 79.23 DALPHA= .04
V=670.2
22. 48-1236
{CuPS3}x
Triklin
Dexp. Dcal. d(D) h k l
7.5418 7.5429 -.0011 1 -1 0
4.9688 4.9685 .0003 -1 -2 0
3.3364 3.3364 .0000 4 0 0
3.1557 3.1573 -.0016 1 -3 0
3.0397 3.0391 .0006 4 -1 0
2.9881 2.9910 -.0029 -4 -2 0
2.9881 2.9882 -.0001 -2 1 1
2.9037 2.9034 .0003 -2 -2 1
2.9037 2.9056 -.0019 1 2 1
2.7997 2.7997 -.0000 -1 2 1
2.6451 2.6478 -.0027 -3 -2 1
2.5623 2.5636 -.0013 -4 -3 0
A= 13.4890 DA= .0006
B= 10.228 DB= .009
C= 3.7433 DC= .0008
GAMMA= 81.65 DGAMMA= .03
BETA = 90.17 DBETA = .01
ALPHA= 93.532 DALPHA= .006
V= 509.98
23. 48-1562
Al13Cr3Cu4
Tetragon
Groupa 85,118,129
Dexp. Dcal. d(D) h k l
2.1770 2.1772 -.0002 1 0 2
2.0700 2.0697 .0003 1 1 0
1.4980 1.4982 -.0002 1 1 3
1.2800 1.2799 .0001 1 1 4
a= 2.9270 c= 6.515
da= .0001 dc= .002
v= 55.81
24. 48-1944
C30H14CuN4O4*2H2O
Rombik
Groupa 19
Dexp. Dcal. d(D) h k l
16.6730 16.7000 -.0270 0 0 1
7.9000 7.8834 .0166 0 2 1
5.9850 5.9874 -.0024 1 1 0
5.1810 5.1796 .0014 1 2 0
3.2880 3.2880 .0000 0 5 2
a= 6.354 b=17.885 c=16.700
da= .001 db= .001 dc= .001
v=1897.8
25. 48-1989
CH4O*CuPO3F
Tetragon
Groupa 105,112,131
Dexp. Dcal. d(D) h k l
8.3500 8.4333 -.0833 1 0 1
5.1500 5.1484 .0016 2 0 0
3.8800 3.9021 -.0221 2 1 2
3.4300 3.4322 -.0022 3 0 0
3.3400 3.3423 -.0023 3 0 1
3.1200 3.1098 .0102 3 0 2
2.9400 2.9396 .0004 0 0 5
a= 10.30 c= 14.70
da= .02 dc= .07
v=1558
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
8.3500 8.3608 -.0108 1 0 1
5.1500 5.1540 -.0040 1 1 0
3.8800 3.8801 -.0001 -2 0 1
3.4300 3.4308 -.0008 -1 1 2
3.3400 3.3416 -.0016 2 0 3
3.1200 3.1201 -.0001 3 0 0
2.9400 2.9388 .0012 2 1 3
a= 9.801 b= 6.174 c= 11.130 beta= 72.75
da= .003 db=.001 dc=.004 dbeta=.01
V= 643.2
26. 48-2103
2C4H9NO2*CuCl2*2H2O
Triklin
Dexp Dcal d(D) h k l
6.0570 6.0494 .0076 1 0 0
5.4570 5.4602 -.0032 -1 1 0
4.0580 4.0635 -.0055 -1 1 1
3.7230 3.7259 -.0029 1 -1 1
3.0930 3.0961 -.0031 -1 2 1
2.7430 2.7415 .0015 1 0 2
2.6650 2.6649 .0001 -1 -1 1
2.5380 2.5363 .0017 -2 2 1
2.3670 2.3671 -.0001 -1 2 2
2.2140 2.2140 .0000 -1 3 1
2.0380 2.0381 -.0001 3 0 1
1.8540 1.8541 -.0001 -2 0 2
1.8240 1.8240 -.0000 3 -1 2
1.6760 1.6761 -.0001 3 -2 2
1.6060 1.6059 .0001 1 -4 0
A= 6.6164 DA= .0008
B= 6.7096 DB= .0006
C= 5.8314 DC= .0002
GAMMA=110.709 DGAMMA= .006
BETA = 83.985 DBETA = .001
ALPHA= 75.799 DALPHA= .001
V=229.5
27. 48-2108
C2H12CuN2O8S2*6H2O
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
9.4012 9.3927 .0085 0 1 1
8.3387 8.3325 .0062 1 1 0
7.2484 7.2458 .0026 -1 1 1
5.8239 5.8240 -.0001 -2 0 1
5.3679 5.3624 .0055 0 2 0
5.0065 5.0033 .0032 1 0 4
3.4501 3.4512 -.0011 1 3 0
3.3606 3.3596 .0010 -1 3 1
2.6727 2.6730 -.0003 1 3 5
2.0385 2.0385 .0000 4 4 4
a= 13.699 b= 10.725 c= 20.14 beta= 75.0423
da= .001 db=.002 dc= .02 dbeta=.0006
V= 2859.0
28. 48-2168
C5H7CuNO4*0.5H2O
Rombik
Groupa 27
Dexp. Dcal. d(D) h k l
7.5000 7.5636 -.0636 1 1 0
5.9100 5.9329 -.0229 0 1 2
5.5400 5.5352 .0048 2 0 0
5.2200 5.2293 -.0093 1 1 2
5.1600 5.1790 -.0190 0 2 0
4.8800 4.8819 -.0019 2 1 0
4.2100 4.2118 -.0018 0 2 2
4.0400 4.0473 -.0073 2 1 2
3.9300 3.9366 -.0066 1 2 2
3.6200 3.6189 .0011 0 0 4
3.4500 3.4527 -.0027 0 3 0
3.2800 3.2875 -.0075 3 0 2
a=11.07038 b=10.358 c=14.48
da= .00003 db= .005 dc= .02
V=1660
29. 48-2193
C10H20CuN2O4S2
Triklin
Dexp Dcal d(D) h k l
13.6000 13.6006 -.0006 1 0 0
8.0400 8.0360 .0040 -1 0 1
5.3400 5.3417 -.0017 -1 -2 1
4.6200 4.6195 .0005 -2 -2 1
4.4600 4.4590 .0010 -3 -1 1
4.3300 4.3290 .0010 -1 0 2
4.0000 4.0001 -.0001 2 1 1
3.6300 3.6297 .0003 -1 2 1
3.4500 3.4498 .0002 -4 -1 1
3.2000 3.1999 .0001 -4 1 0
2.9400 2.9403 -.0003 4 0 1
2.7100 2.7100 .0000 0 -4 2
A= 14.0573 DA= .0009
B= 11.1159 DB= .0003
C= 9.6631 DC= .0006
GAMMA= 82.6978 DGAMMA= .0003
BETA =104.609 DBETA = .008
ALPHA=115.861 DALPHA= .007
V= 1314.7
30. 48-2229
C20H44Br6Cu4N4O
Triklin
Dexp Dcal d(D) h k l
10.7170 10.7117 .0053 1 0 0
8.8450 8.8486 -.0036 0 1 0
7.8999 7.8979 .0020 -1 0 1
6.8624 6.8554 .0070 0 -1 1
6.7071 6.7011 .0060 1 -1 1
6.2369 6.2276 .0093 1 0 2
5.1257 5.1433 -.0176 1 1 2
4.9828 4.9782 .0046 0 -1 2
4.4394 4.4431 -.0037 0 1 3
3.9001 3.9051 -.0050 2 1 2
3.8667 3.8657 .0010 1 -1 3
3.7540 3.7570 -.0030 2 -2 1
A= 11.183 DA= .002
B= 9.315 DB= .004
C= 14.10 DC= .01
GAMMA=104.36 DGAMMA= .02
BETA = 84.12 DBETA = .03
ALPHA= 80.59 DALPHA= .01
V= 1388.3
31. 48-2230
C20H44Br4Cl2Cu4N4O
Triklin
Dexp Dcal d(D) h k l
9.7177 9.7190 -.0013 1 0 0
8.5057 8.4691 .0366 1 -1 1
7.0811 7.0846 -.0035 -1 0 1
6.4634 6.4371 .0263 0 1 1
6.1935 6.1880 .0055 0 -1 2
5.6443 5.6528 -.0085 -1 1 1
4.9690 4.9716 -.0026 2 -1 2
4.4394 4.4410 -.0016 -1 -1 2
4.1713 4.1770 -.0057 2 -1 3
4.0767 4.0760 .0007 1 -2 3
3.8502 3.8498 .0004 2 -2 3
3.5900 3.5879 .0021 3 -1 1
A= 10.8174 DA= .0007
B= 9.888 DB= .001
C= 14.600 DC= .005
GAMMA=112.78 DGAMMA= .01
BETA = 70.073 DBETA = .001
ALPHA=112.78 DALPHA= .02
V=1294.0
32. 48-2231
C20H44Br3Cl3Cu4N4O
Triklin
Dexp Dcal d(D) h k l
9.7177 9.7141 .0036 1 0 0
8.5057 8.5105 -.0048 0 1 1
7.8999 7.8989 .0010 0 -1 1
4.9552 4.9549 .0003 1 -2 1
3.9342 3.9340 .0002 -2 2 1
3.8176 3.8175 .0001 0 1 3
3.6187 3.6183 .0004 1 -1 3
3.5758 3.5757 .0001 2 1 2
3.0893 3.0894 -.0001 3 -2 1
3.0079 3.0071 .0008 3 -1 2
2.9121 2.9121 .0000 -1 4 0
2.8488 2.8489 -.0001 3 -2 2
2.6518 2.6521 -.0003 3 -1 3
2.3769 2.3769 -.0000 4 -1 2
A= 10.0367 DA= .0008
B= 11.6824 DB= .0005
C= 11.919 DC= .001
GAMMA=103.435 DGAMMA= .007
BETA = 85.18 DBETA = .01
ALPHA= 86.9868 DALPHA= .0007
V= 1350.74
33. 48-2232
C20H44Br2Cl4Cu4N4O
Triklin
Dexp Dcal d(D) h k l
9.6123 9.6441 -.0318 0 1 0
8.3457 8.3699 -.0242 1 1 0
5.7166 5.7234 -.0068 1 1 2
7.6945 7.7021 -.0076 1 0 1
6.3256 6.3249 .0007 -1 1 0
5.9654 5.9625 .0029 0 -1 1
5.5912 5.5974 -.0062 1 2 1
5.5391 5.5518 -.0127 -1 -1 1
4.9279 4.9285 -.0006 1 2 0
3.9256 3.9280 -.0024 -1 2 2
3.6851 3.6819 .0032 -2 0 2
3.5828 3.5802 .0026 -2 1 2
A= 11.24 DA= .01
B= 11.393 DB= .002
C= 12.146 DC= .009
GAMMA= 70.82 DGAMMA= .03
BETA = 78.86 DBETA = .04
ALPHA= 61.68 DALPHA= .02
V=1291.4
34. 48-2233
C20H44Cl6Cu4N4O
Triklin
Dexp Dcal d(D) h k l
9.6647 9.6831 -.0184 1 0 0
8.4249 8.4153 .0096 1 1 0
7.8302 7.8099 .0203 0 0 1
6.3256 6.3142 .0114 -1 0 1
6.1086 6.1171 -.0085 0 -1 1
5.7166 5.7137 .0029 -1 -1 1
4.9279 4.9186 .0093 2 1 0
3.9689 3.9714 -.0025 -1 2 1
3.6926 3.6984 -.0058 -2 -2 1
3.6332 3.6338 -.0006 1 -2 1
3.5477 3.5473 .0004 1 1 2
3.4796 3.4806 -.0010 1 3 1
A= 10.029 DA= .005
B= 11.43 DB= .02
C= 7.853 DC= .001
GAMMA= 75.53 DGAMMA= .08
BETA = 93.09 DBETA = .03
ALPHA= 85.78 DALPHA= .02
V= 866.55
35. 48-2234
C16H36Br6Cu4N4O5
Triklin
Dexp Dcal d(D) h k l
11.7860 11.7665 .0195 1 0 0
11.4810 11.4446 .0364 0 1 0
9.3094 9.3156 -.0062 -1 0 1
8.7577 8.7459 .0118 0 -1 1
8.2679 8.2682 -.0003 0 0 2
7.3143 7.3129 .0014 0 1 2
6.2809 6.2850 -.0041 -1 -1 1
5.8672 5.8711 -.0039 -1 2 0
5.5049 5.5121 -.0072 0 0 3
5.4378 5.4364 .0014 -2 0 1
5.0107 5.0012 .0095 -1 1 3
4.6707 4.6694 .0013 2 1 1
A= 12.3142 DA= .0002
B= 12.127 DB= .002
C= 16.7781 DC= .0002
GAMMA=106.79 DGAMMA= .01
BETA = 89.22 DBETA = .01
ALPHA= 80.95 DALPHA= .01
V=2366.0
36. 48-2235
C16H36Br4Cl2Cu4N4O5
Triklin
Dexp Dcal d(D) h k l
11.9460 11.9617 -.0157 1 0 0
10.6520 10.6367 .0153 -1 1 0
9.7498 9.7593 -.0095 -1 1 1
9.0251 9.0565 -.0314 -1 0 1
8.7577 8.7484 .0093 1 0 1
7.9708 7.9858 -.0150 1 1 0
7.1958 7.1893 .0065 -1 2 1
5.9060 5.9054 .0006 -1 0 2
5.5391 5.5282 .0109 -2 0 1
4.8217 4.8202 .0015 2 1 1
4.5988 4.6028 -.0040 -1 -2 1
4.4394 4.4385 .0009 0 0 3
A= 12.590 DA= .001
B= 15.320 DB= .009
C= 14.22 DC= .01
GAMMA=108.07 DGAMMA= .09
BETA = 98.01 DBETA = .08
ALPHA= 69.58 DALPHA= .06
V= 2441.5
37. 48-2236
C16H36Br3Cl3Cu4N4O5
Triklin
Dexp Dcal d(D) h k l
12.1090 12.1319 -.0229 0 1 1
10.6520 10.5992 .0528 1 1 0
9.1179 9.1374 -.0195 0 -1 1
8.6721 8.6725 -.0004 1 1 2
8.2679 8.2634 .0045 -1 1 0
7.9708 7.9729 -.0021 1 0 2
7.3143 7.3081 .0062 1 2 1
7.0251 7.0399 -.0148 2 1 1
6.6569 6.6705 -.0136 0 2 0
5.9060 5.9030 .0030 2 2 1
5.6443 5.6412 .0031 0 -2 1
5.5049 5.5045 .0004 1 2 3
A= 14.2128 DA= .0001
B= 14.859 DB= .004
C= 18.360 DC= .006
GAMMA= 69.35 DGAMMA= .01
BETA = 67.65 DBETA = .02
ALPHA= 67.80 DALPHA= .02
V=3222.2
38. 48-2237
C16H36Cl6Cu4N4O5
Triklin
Dexp Dcal d(D) h k l
12.2770 12.2715 .0055 1 0 0
11.6320 11.6155 .0165 0 1 0
10.9150 10.8918 .0232 0 1 1
10.2810 10.3560 -.0750 1 0 1
9.0251 9.0030 .0221 -1 1 1
8.5057 8.4989 .0068 -1 0 1
7.9708 7.9886 -.0178 1 -1 1
7.8302 7.8370 -.0068 0 -1 1
7.5634 7.4948 .0686 1 1 1
7.1958 7.1917 .0041 0 1 2
6.2369 6.2434 -.0065 -1 2 1
5.7722 5.7567 .0155 -1 -1 1
A= 13.18747 DA= .00004
B= 12.93647 DB= .00009
C= 15.0997 DC= .0006
GAMMA=108.3516 DGAMMA= .0006
BETA = 84.695 DBETA = .002
ALPHA= 73.9023 DALPHA= .0003
V=2303