1. 22-0506
{NH4}4{NiH6Mo6O24}85H2O
Rombik
Groupa 17
Dexp. Dcal. d(D) h k l
11.0129 11.1621 -.1492 0 1 1
8.0372 8.1285 -.0913 0 0 2
7.1887 7.1838 .0049 0 1 2
5.7944 5.7839 .0105 1 1 0
5.4107 5.4190 -.0083 0 0 3
5.1054 5.1177 -.0123 0 3 0
3.7438 3.7356 .0082 0 4 1
3.1316 3.1322 -.0006 0 4 3
3.0307 3.0336 -.0029 1 4 2
2.7908 2.7905 .0003 0 4 4
2.7103 2.7095 .0008 0 0 6
2.6303 2.6301 .0002 2 3 1
a= 6.244 b=15.353 c=16.26
da= .004 db= .006 dc= .02
v=1558
2. 22-0627
Fe8Ni8S16
Rombik
Groupa 29,57
Dexp. Dcal. d(D) h k l
3.3105 3.3023 .0082 2 2 0
2.9897 3.0064 -.0167 0 3 0
2.8830 2.8716 .0114 1 3 0
2.6301 2.6275 .0026 3 2 0
2.2501 2.2548 -.0047 0 4 0
2.0401 2.0446 -.0045 2 4 0
1.8031 1.8038 -.0007 0 5 0
1.7099 1.7106 -.0007 3 4 1
1.5910 1.5911 -.0001 6 1 0
a= 9.699 b= 9.02 c= 4.5012
da= .003 db= .02 dc= .0007
V= 393.7
3. 22-0722
MnNiVO4
Triklin
Dexp Dcal d(D) h k l
5.8705 5.8666 .0039 -1 1 0
4.9603 4.9668 -.0065 0 1 1
4.8304 4.8313 -.0009 -1 1 1
4.2703 4.2820 -.0117 1 0 1
3.4403 3.4416 -.0013 -2 1 1
3.3702 3.3711 -.0008 -2 0 1
3.0802 3.0766 .0036 0 0 2
3.0202 3.0227 -.0024 -1 1 2
2.9202 2.9188 .0014 -2 2 1
2.7502 2.7505 -.0003 0 -1 2
2.6102 2.6072 .0030 -1 2 2
2.5802 2.5798 .0004 -2 0 2
A= 7.515 DA= .001
B= 7.69 DB= .01
C= 6.33 DC= .01
GAMMA=104.88 DGAMMA= .02
BETA =102.44 DBETA = .03
ALPHA= 81.72 DALPHA= .09
V= 343.7
4. 22-0746
Ni3.5Cd0.5GeO3
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
4.8202 4.8028 .0175 2 0 0
4.4403 4.4397 .0007 -1 1 1
3.7902 3.7807 .0096 1 1 1
3.4202 3.4218 -.0016 0 2 1
3.3102 3.3111 -.0009 2 2 0
3.0202 3.0216 -.0014 -2 2 1
2.9102 2.9085 .0017 -3 1 1
2.6002 2.5995 .0007 2 2 1
2.5802 2.5804 -.0002 0 0 2
2.4702 2.4698 .0003 3 0 1
2.4002 2.4014 -.0012 4 0 0
2.2802 2.2809 -.0008 1 1 2
2.2201 2.2198 .0003 -2 2 2
a= 9.891 b= 9.142 c= 5.314 beta= 103.78
da= .006 db=.006 dc=.001 dbeta=.01
V= 466.6
Triklin
Dexp Dcal d(D) h k l
4.8202 4.8257 -.0054 1 1 0
4.4403 4.4395 .0008 0 1 1
3.7902 3.7812 .0090 0 -1 1
3.4202 3.4203 -.0000 -1 -1 1
3.3102 3.3110 -.0008 -1 1 0
3.0202 3.0221 -.0019 0 1 2
2.9102 2.9099 .0003 2 0 0
2.6002 2.6003 -.0001 0 -1 2
2.5802 2.5801 .0001 0 2 0
2.4702 2.4701 .0001 1 2 2
2.4002 2.4001 .0001 -1 -1 2
2.2802 2.2810 -.0008 0 -2 1
2.2201 2.2197 .0004 0 2 2
A= 6.500 DA= .004
B= 5.729 DB= .004
C= 6.991 DC= .002
GAMMA= 65.93 DGAMMA= .05
BETA = 73.89 DBETA = .02
ALPHA= 75.10 DALPHA= .03
V= 225.2
5. 22-0838
K4{NiH6Mo6O24}*5H2O
Triklin
Dexp Dcal d(D) h k l
10.3003 10.2766 .0237 1 0 0
7.8509 7.8762 -.0253 -1 1 0
7.2104 7.2102 .0002 0 0 1
5.9003 5.8935 .0067 1 0 1
5.5703 5.5749 -.0045 1 1 0
5.2104 5.2071 .0033 -1 -1 1
4.8503 4.8472 .0030 1 -2 1
3.7402 3.7407 -.0005 1 -2 2
3.4503 3.4506 -.0003 2 -2 2
3.0902 3.0903 -.0001 3 0 1
2.9002 2.9003 -.0001 -2 -2 1
2.6902 2.6902 .0000 1 1 2
A= 11.088 DA= .007
B= 9.863 DB= .009
C= 8.101 DC= .007
GAMMA=112.07 DGAMMA= .09
BETA = 80.30 DBETA = .07
ALPHA=117.13 DALPHA= .04
V= 730.8
6. 22-1181
C4H18N4NiO4
Triklin
Dexp Dcal d(D) h k l
6.9104 6.9009 .0095 -1 1 0
5.9803 5.9829 -.0026 1 1 1
5.1202 5.1288 -.0085 1 -1 1
4.8703 4.8702 .0002 -1 2 0
4.4503 4.4539 -.0036 -1 0 1
4.2003 4.1974 .0029 2 0 1
3.9603 3.9633 -.0030 -2 1 0
3.8602 3.8637 -.0035 2 1 0
3.8302 3.8264 .0038 2 -1 1
3.5803 3.5809 -.0006 -1 3 0
3.4503 3.4505 -.0002 -2 2 0
3.3403 3.3388 .0015 0 1 2
A= 8.821 DA= .009
B= 11.991 DB= .004
C= 7.098 DC= .009
GAMMA= 87.85 DGAMMA= .06
BETA = 70.44 DBETA = .09
ALPHA= 77.11 DALPHA= .05
V= 689.1
7. 22-1183
Ni2B2O5
Triklin
Dexp Dcal d(D) h k l
8.7480 8.7459 .0021 1 0 0
5.9952 5.9979 -.0028 -1 1 0
5.6248 5.6252 -.0004 -1 0 1
4.4638 4.4754 -.0115 0 -1 1
4.3838 4.3730 .0108 2 0 0
4.0536 4.0569 -.0033 -2 0 1
3.1828 3.1814 .0013 -2 -1 1
3.0827 3.0766 .0060 2 -1 1
2.9997 2.9990 .0007 -2 2 0
2.9306 2.9353 -.0047 -3 0 1
2.8225 2.8226 -.0001 -1 1 2
2.7094 2.7090 .0003 -2 1 2
A= 9.3307 DA= .0001
B= 6.785 DB= .001
C= 6.128 DC= .001
GAMMA=103.89 DGAMMA= .07
BETA =105.07 DBETA = .07
ALPHA= 88.251 DALPHA= .002
V= 363.47
8. 22-1186
C2H12N6NiO4*0.75H2O
Triklin
Dexp Dcal d(D) h k l
7.4870 7.5020 -.0150 0 1 0
7.0063 6.9959 .0104 2 0 0
5.8851 5.8769 .0082 -2 1 0
4.6041 4.5908 .0133 2 1 0
3.6332 3.6303 .0029 1 0 1
3.4930 3.4886 .0044 -1 1 1
2.7924 2.7942 -.0018 -2 2 1
2.4822 2.4811 .0011 -4 0 1
2.3721 2.3718 .0003 3 -2 1
2.1919 2.1922 -.0003 2 3 0
1.9417 1.9419 -.0002 0 -3 1
1.9217 1.9213 .0004 1 -4 0
A= 14.425 DA= .001
B= 7.8129 DB= .0001
C= 3.7505 DC= .0004
GAMMA=103.772 DGAMMA= .005
BETA = 89.109 DBETA = .004
ALPHA= 81.810 DALPHA= .007
V=405.7
9. 22-1188
C2H8N4NiO4*0.5H2O
Rombik
Groupa 17
Dexp. Dcal. d(D) h k l
6.0154 5.9778 .0376 2 0 0
5.2345 5.2640 -.0295 0 1 0
3.8934 3.8903 .0031 0 0 1
3.6932 3.6994 -.0062 1 0 1
3.1328 3.1286 .0041 0 1 1
2.7824 2.7838 -.0014 3 0 1
2.6323 2.6320 .0003 0 2 0
a=11.956 b= 5.264003 c= 3.8903
da= .004 db= .000004 dc= .0003
V= 244.83
10. 22-1839
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
10.3003 10.2823 .0180 0 1 0
6.6104 6.6074 .0030 1 1 1
6.2405 6.2514 -.0109 -1 0 1
4.7504 4.7529 -.0025 2 0 0
4.1903 4.1881 .0022 -1 0 2
3.4903 3.4900 .0003 2 2 0
3.0602 3.0607 -.0004 1 2 3
a= 10.01 b= 10.28 c= 11.46 beta=71.7
da= .04 db=.03 dc=.08 dbeta=.4
V= 1120
11. 22-1840
C20H24N2NiO4
Rombik
Grupa 17
Dexp. Dcal. d(D) h k l
7.9005 7.8666 .0340 0 1 0
7.5306 7.6498 -.1191 1 0 1
6.6604 6.6783 -.0179 0 1 1
6.3705 6.3185 .0520 0 0 2
5.5003 5.4842 .0160 1 1 1
4.8202 4.8054 .0149 2 0 0
4.3703 4.3838 -.0135 1 1 2
4.2103 4.2123 -.0020 0 0 3
4.1102 4.1008 .0094 2 1 0
3.9302 3.9333 -.0030 0 2 0
3.8302 3.8249 .0053 2 0 2
3.8002 3.8249 -.0247 2 0 2
3.4903 3.4980 -.0077 1 2 1
2.4702 2.4670 .0031 2 2 3
a= 9.611 b= 7.867 c=12.64
da= .002 db= .008 dc= .01
v= 955
Triklin
Dexp Dcal d(D) h k l
7.9005 7.8736 .0269 1 0 0
7.5306 7.4684 .0622 0 0 1
6.6604 6.6704 -.0099 0 1 1
6.3705 6.3547 .0158 -1 1 1
5.5003 5.4939 .0064 -1 0 1
4.8202 4.8143 .0059 1 1 0
4.3703 4.3665 .0038 1 1 1
4.2103 4.2109 -.0006 0 2 0
4.1102 4.1061 .0042 -2 1 1
3.9302 3.9368 -.0066 2 0 0
3.8302 3.8329 -.0027 -1 1 2
3.8002 3.7998 .0004 -2 2 0
3.4903 3.4894 .0009 2 -1 1
2.4702 2.4701 .0001 3 -2 1
A= 8.859 DA= .002
B= 9.931 DB= .002
C= 7.9614 DC= .0008
GAMMA=117.25 DGAMMA= .02
BETA =100.43 DBETA = .02
ALPHA= 69.79 DALPHA= .07
V=584.5
12. 22-1841
C4H12N2NiS2
Rombik
Groupa 30,53
Dexp. Dcal. d(D) h k l
6.2506 6.2673 -.0167 2 1 0
5.1403 5.1309 .0093 2 2 0
4.8304 4.8282 .0022 1 3 0
3.7203 3.7236 -.0033 1 4 0
2.9502 2.9528 -.0026 3 4 0
2.7002 2.6997 .0004 5 1 0
2.6802 2.6802 .0000 0 5 1
1.9906 1.9902 .0004 3 7 0
a=13.709 b=15.48 c= 5.36
da= .006 db= .01 dc= .01
V=1137
13. 22-1842
C20H32Cl2NiO16
Triklin
Dexp Dcal d(D) h k l
10.4006 10.4089 -.0082 1 0 0
7.1905 7.1710 .0195 0 1 1
6.5806 6.5620 .0186 -1 0 1
6.3705 6.3287 .0417 -1 1 0
6.1606 6.1395 .0211 1 1 1
5.9803 5.9538 .0265 1 1 0
4.9504 4.9447 .0057 0 0 2
4.8804 4.8804 .0000 0 1 2
4.6904 4.6985 -.0081 1 1 2
4.2704 4.2764 -.0060 -2 0 1
4.0202 4.0206 -.0004 2 -1 1
3.7903 3.7950 -.0047 0 2 0
A= 10.6105 DA= .0004
B= 7.9708 DB= .0007
C= 10.565 DC= .002
GAMMA= 90.30 DGAMMA= .01
BETA = 79.43 DBETA = .01
ALPHA= 72.59 DALPHA= .01
V=836
14. 22-1843
C10H16Cl2NiO12*2H2O
Triklin
Dexp Dcal d(D) h k l
13.1016 13.0865 .0151 1 0 0
8.8404 8.8599 -.0195 0 1 1
7.5608 7.5732 -.0125 0 -1 1
7.3305 7.3376 -.0071 -1 0 1
7.0207 7.0165 .0041 2 1 0
6.4606 6.4184 .0422 1 -1 1
6.4104 6.4184 -.0080 1 -1 1
6.2305 6.2145 .0159 2 0 1
5.1503 5.1539 -.0036 -1 2 0
4.9204 4.9266 -.0062 1 2 2
4.8304 4.8342 -.0038 2 -1 1
4.5504 4.5512 -.0008 1 -2 1
A= 14.92 DA= .01
B= 14.82 DB= .02
C= 11.06 DC= .01
GAMMA= 64.32 DGAMMA= .07
BETA = 71.42 DBETA = .07
ALPHA= 74.04 DALPHA= .09
V= 2063.0
15. 22-1844
C12H30N2NiO12
Triklin
Dexp Dcal d(D) h k l
7.9708 7.9755 -.0048 0 1 0
7.2403 7.2287 .0116 1 -1 1
5.5703 5.5706 -.0003 0 -1 2
5.2104 5.2100 .0004 1 -1 2
4.6203 4.6235 -.0032 1 0 2
4.3804 4.3764 .0040 -1 2 0
4.0303 4.0243 .0060 2 0 1
3.9103 3.9111 -.0009 0 -2 2
3.7303 3.7258 .0045 -1 2 1
3.5303 3.5321 -.0018 -2 1 2
3.4002 3.4007 -.0005 -2 -1 1
3.1402 3.1392 .0010 2 -1 3
A= 9.787 DA= .004
B= 9.215 DB= .001
C= 12.096 DC= .003
GAMMA=114.010 DGAMMA= .003
BETA = 87.384 DBETA = .002
ALPHA=108.10 DALPHA= .02
V= 943.2
16. 22-1845
C16H14NiS6
Triklin
Dexp Dcal d(D) h k l
9.6602 9.6678 -.0076 0 0 1
7.4404 7.4350 .0054 0 -1 1
5.7303 5.7263 .0040 -1 0 1
5.5003 5.4956 .0046 0 3 1
5.2903 5.2895 .0008 -1 -1 1
4.5402 4.5447 -.0045 -1 -2 1
4.1102 4.1094 .0009 -1 0 2
3.6902 3.6909 -.0007 1 4 1
3.4402 3.4403 -.0001 -1 -2 2
3.2802 3.2812 -.0010 0 5 0
3.1802 3.1794 .0008 0 5 2
3.0402 3.0391 .0011 -1 -3 2
A= 6.633 DA= .002
B= 17.219 DB= .004
C= 10.1370 DC= .0003
GAMMA= 84.91 DGAMMA= .03
BETA = 94.44 DBETA = .01
ALPHA= 73.590 DALPHA= .001
V= 1099.9
17. 22-1847
C20H30Cl2NiP2
Rombik
Groupa 26,28,51
Dexp. Dcal. d(D) h k l
8.5105 8.6241 -.1136 0 1 0
7.4805 7.4607 .0198 1 1 0
5.6305 5.6320 -.0016 2 1 0
4.9204 4.9580 -.0375 3 0 0
4.3103 4.3120 -.0017 0 2 0
4.0102 4.0102 .0000 0 0 2
3.8002 3.7885 .0117 3 1 1
3.4202 3.4146 .0056 4 1 0
3.3703 3.3735 -.0033 4 0 1
2.8802 2.8810 -.0008 1 2 2
a=14.874 b= 8.624 c= 8.020
da= .002 db= .001 dc= .005
V=1028.8
18. 22-1851
C22H24N2NiO2
Triklin
Dexp Dcal d(D) h k l
13.1016 13.0908 .0107 1 0 0
6.8005 6.8122 -.0117 -1 1 0
5.7805 5.7701 .0104 0 0 1
5.4204 5.4079 .0125 -1 0 1
4.9603 4.9608 -.0005 2 1 0
4.4703 4.4712 -.0009 -2 0 1
3.7303 3.7307 -.0004 1 2 0
3.5803 3.5917 -.0113 -3 0 1
3.2402 3.2385 .0017 1 2 1
3.0902 3.0911 -.0009 -2 2 1
2.9902 2.9919 -.0017 4 1 0
2.8802 2.8791 .0011 3 2 0
A= 13.124 DA= .005
B= 7.886 DB= .006
C= 5.808 DC= .005
GAMMA= 91.91 DGAMMA= .01
BETA = 93.80 DBETA = .02
ALPHA= 84.56 DALPHA= .07
V= 596.8
Triklin
Dexp Dcal d(D) h k l
13.1016 13.1249 -.0234 1 0 0
6.8005 6.7925 .0079 0 0 1
5.7805 5.7639 .0166 1 0 1
5.4204 5.4093 .0112 -1 -1 1
4.9603 4.9539 .0064 0 1 1
4.4703 4.4660 .0043 2 0 1
3.7303 3.7311 -.0008 0 -2 1
3.5803 3.5824 -.0021 2 2 0
3.2402 3.2397 .0005 3 -1 1
3.0902 3.0891 .0011 1 -1 2
2.9902 2.9911 -.0009 -4 1 0
2.8802 2.8819 -.0017 2 0 2
A= 13.250 DA= .004
B= 8.3261 DB= .0002
C= 6.8976 DC= .0008
GAMMA= 85.8945 DGAMMA= .0005
BETA = 97.181 DBETA = .007
ALPHA= 97.456 DALPHA= .003
V=747.1
19. 23-0228
Cu3Ni2As2
Triklin
Dexp Dcal d(D) h k l
4.8804 4.8762 .0042 1 0 0
3.2102 3.2109 -.0007 -1 2 1
3.1502 3.1469 .0033 1 0 1
2.8302 2.8319 -.0016 -1 2 0
2.7202 2.7199 .0003 -2 1 1
2.4502 2.4542 -.0040 -2 1 0
2.4302 2.4293 .0009 -2 2 1
2.2201 2.2191 .0010 -1 3 1
1.9601 1.9601 .0001 -2 3 1
1.9001 1.9007 -.0006 0 3 2
1.8601 1.8600 .0001 2 1 1
1.6901 1.6901 -.0000 -2 0 3
1.4201 1.4201 .0000 -3 3 0
1.3701 1.3701 -.0000 0 4 3
A= 5.4538 DA= .0003
B= 6.6878 DB= .0002
C= 6.086 DC= .005
GAMMA=110.42 DGAMMA= .05
BETA =113.55 DBETA = .06
ALPHA= 65.75 DALPHA= .02
V= 180.9
20. 23-0433
C4H4NiO6*2.5H2O
Triklin
Dexp Dcal d(D) h k l
6.0654 6.0580 .0074 0 1 1
5.2147 5.2146 .0000 1 1 0
4.5340 4.5384 -.0044 0 -1 1
4.0435 4.0376 .0059 -1 0 1
3.6733 3.6744 -.0011 0 0 2
3.4531 3.4490 .0041 1 2 0
3.4030 3.4024 .0006 1 2 2
3.1228 3.1256 -.0028 2 0 1
2.8825 2.8836 -.0010 2 2 2
2.8324 2.8317 .0007 1 -1 2
2.6523 2.6527 -.0003 1 3 1
2.4922 2.4922 .0000 0 3 1
A= 6.71 DA= .01
B= 8.001 DB= .004
C= 8.401 DC= .006
GAMMA= 69.30 DGAMMA= .06
BETA = 65.73 DBETA = .07
ALPHA= 67.36 DALPHA= .04
V= 369.1
21. 23-1679
c26H34N2NiO2
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
12.9010 12.9158 -.0148 1 0 0
8.0103 8.0147 -.0044 1 0 1
6.4606 6.4579 .0027 2 0 0
5.8205 5.8187 .0018 -1 1 1
4.9305 4.9280 .0025 2 1 1
4.4902 4.4886 .0016 -2 1 1
4.2803 4.2824 -.0021 1 2 1
3.9603 3.9624 -.0021 3 1 0
3.7703 3.7689 .0014 2 2 1
3.3802 3.3811 -.0009 1 2 2
2.9302 2.9301 .0001 2 0 3
a= 13.020 b= 10.13 c= 9.32 beta= 82.7
da=.009 db=.03 dc=.02 dbeta=.1
V= 1220.3
Triklin
Dexp Dcal d(D) h k l
12.9010 12.8926 .0084 1 0 0
8.0103 8.0120 -.0017 0 1 0
6.4606 6.4605 .0001 -1 1 1
5.8205 5.8181 .0024 2 1 0
4.9305 4.9304 .0000 -2 1 1
4.4902 4.4905 -.0002 -2 1 2
4.2803 4.2807 -.0004 3 1 0
3.9603 3.9602 .0001 -3 -1 2
3.7703 3.7703 .0000 -3 1 1
3.3802 3.3803 -.0001 -3 -2 1
2.9302 2.9302 .0000 3 -1 1
A= 14.4129 DA= .0009
B= 8.3803 DB= .0006
C= 12.005 DC= .003
GAMMA= 79.215 DGAMMA= .005
BETA =112.10 DBETA = .02
ALPHA= 82.03 DALPHA= .05
V= 1284.5
22. 23-0795
C4H8Cl2N2ONi
Triklin
Dexp Dcal d(D) h k l
7.8970 7.8857 .0113 0 1 0
6.9163 6.9222 -.0059 -1 0 1
5.4346 5.4356 -.0010 0 -1 2
4.7942 4.7948 -.0006 -1 1 0
4.1537 4.1511 .0026 0 1 2
3.6332 3.6322 .0010 -1 1 2
3.4030 3.4056 -.0026 -2 -2 1
2.9987 2.9983 .0003 -2 1 1
2.8935 2.8936 -.0001 0 0 4
2.7965 2.7964 .0000 1 2 2
2.7304 2.7312 -.0008 0 -3 1
2.6593 2.6593 .0000 -3 -1 2
A= 8.068 DA= .001
B= 8.744 DB= .002
C= 12.6373 DC= .0004
GAMMA= 69.765 DGAMMA= .002
BETA =107.664 DBETA = .003
ALPHA=110.59 DALPHA= .01
V= 766.2
23. 23-1797
C3H2NiO4*2H2O
Triklin
Dexp Dcal d(D) h k l
5.7803 5.7788 .0014 -1 0 1
5.4203 5.4191 .0012 0 1 1
5.1203 5.1246 -.0042 0 -1 1
3.8303 3.8330 -.0027 0 2 0
3.6803 3.6803 -.0001 2 -1 1
3.6203 3.6227 -.0024 0 0 2
3.6003 3.5967 .0036 -2 -1 1
3.3402 3.3403 -.0001 1 2 1
3.2502 3.2469 .0033 1 1 2
3.1602 3.1575 .0026 1 -2 1
3.1102 3.1109 -.0007 -3 1 0
3.0402 3.0405 -.0002 -2 2 0
A= 10.351 DA= .007
B= 7.6812 DB= .0007
C= 7.269 DC= .004
GAMMA= 88.33 DGAMMA= .05
BETA = 86.65 DBETA = .01
ALPHA= 86.710 DALPHA= .004
V=575.0
24. 23-1798
C30H30B2F8NiN6O6
Triklin
Dexp Dcal d(D) h k l
5.7803 5.7881 -.0078 0 1 1
5.4203 5.4188 .0015 0 -1 1
5.1203 5.1234 -.0030 1 2 0
3.8303 3.8315 -.0013 1 -2 1
3.6803 3.6791 .0011 -1 0 1
3.6203 3.6187 .0016 -1 -1 1
3.6003 3.6038 -.0036 0 3 1
3.3402 3.3404 -.0002 0 -3 1
3.2502 3.2478 .0023 2 1 2
3.1602 3.1566 .0036 -1 3 0
3.1102 3.1149 -.0047 1 4 0
3.0402 3.0380 .0022 1 -3 1
A= 7.673 DA= .001
B= 13.2160 DB= .0004
C= 7.318 DC= .001
GAMMA= 71.375 DGAMMA= .007
BETA = 59.102 DBETA = .006
ALPHA= 76.657 DALPHA= .008
V=601.5
25. 23-1799
C5H5NNiO8Re2
Triklin
Dexp Dcal d(D) h k l
7.8006 7.7962 .0044 1 0 0
7.2504 7.2312 .0192 -1 1 0
5.7903 5.7822 .0081 1 0 1
5.1004 5.1017 -.0013 -1 1 1
4.4404 4.4412 -.0008 -1 2 0
4.2003 4.1995 .0008 -2 1 0
4.0403 4.0397 .0006 -1 -1 1
3.8602 3.8615 -.0013 2 -1 1
3.3802 3.3806 -.0004 -2 0 1
3.1202 3.1203 -.0001 1 1 2
2.9502 2.9503 -.0000 2 1 1
2.7402 2.7401 .0000 -2 1 2
A= 8.4748 DA= .0002
B= 9.0110 DB= .0002
C= 7.8932 DC= .0007
GAMMA=112.6112 DGAMMA= .0008
BETA = 84.515 DBETA = .001
ALPHA= 92.721 DALPHA= .004
V=553.9