0 mol 7 unq 0 iso 0 dist 7.31201 9.36807 6.57017 5.44992 9.55056 7.45262 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.31201 9.36807 6.57017 4.74523 7.57354 6.96586 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.36807 7.31201 6.57017 5.44992 7.45262 9.55056 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.36807 7.31201 6.57017 4.74523 6.96586 7.57354 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 6.33889 6.85412 5.80437 11.0722 9.82483 10.4906 numMergedOcc 0
5 mol 16 unq 0 iso 0 dist 8.41862 6.58035 10.9633 6.70071 7.40724 11.6017 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 7.33969 7.45237 4.85203 11.962 8.19733 9.95025 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.46761 7.58407 6.44201 11.3547 7.93481 11.0854 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 9.73139 6.31428 6.44201 11.9834 7.93481 11.0854 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 7.04352 8.1114 14.4772 4.85355 9.52877 8.82738 numMergedOcc 0
10 mol 69 unq 1 iso 0 dist 8.1114 7.04352 14.4772 4.85355 8.82738 9.52877 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 6.99777 9.14376 11.889 7.3094 9.9928 9.68845 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.19042 9.38288 6.59581 7.61939 9.87025 15.0419 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.19042 7.44174 8.58342 7.61939 9.87025 5.85818 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 7.44174 9.38288 11.6138 9.15779 9.05798 16.3381 numMergedOcc 0
15 mol 119 unq 3 iso 0 dist 7.44174 9.38288 11.6138 7.61939 5.85818 15.0419 numMergedOcc 0
16 mol 119 unq 4 iso 0 dist 7.44174 6.19042 8.58342 9.15779 9.05798 14.5501 numMergedOcc 0
17 mol 119 unq 5 iso 0 dist 7.44174 6.19042 8.58342 7.61939 5.85818 9.87025 numMergedOcc 0
18 mol 119 unq 6 iso 0 dist 8.43904 9.80862 4.84196 10.326 9.87025 14.4611 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 7.66168 9.12581 6.09983 11.576 6.42785 10.3718 numMergedOcc 0
20 mol 130 unq 1 iso 0 dist 7.66168 9.12581 6.09983 4.28797 6.82089 5.38314 numMergedOcc 0
21 mol 130 unq 2 iso 0 dist 6.89257 8.74308 6.09983 5.97111 6.42785 10.3718 numMergedOcc 0
22 mol 130 unq 3 iso 0 dist 6.89257 8.74308 6.09983 6.97875 6.82089 5.38314 numMergedOcc 0
23 mol 130 unq 4 iso 0 dist 9.12581 7.66168 6.09983 4.28797 5.38314 6.82089 numMergedOcc 0
24 mol 130 unq 5 iso 0 dist 8.74308 6.89257 6.09983 6.97875 5.38314 6.82089 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 7.20046 7.13543 6.33699 5.93488 7.345 9.52987 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 7.13543 7.20046 6.33699 5.93488 9.52987 7.345 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 7.98142 7.37327 6.46849 9.92777 5.49808 7.96291 numMergedOcc 0
28 mol 181 unq 3 iso 0 dist 7.37327 7.98142 6.46849 9.92777 7.96291 5.49808 numMergedOcc 0
29 mol 197 unq 0 iso 0 dist 8.99696 7.85058 14.5931 15.4462 9.71865 22.7056 numMergedOcc 0
30 mol 197 unq 1 iso 0 dist 8.99696 9.96638 8.44549 15.4462 9.71865 18.0277 numMergedOcc 0
31 mol 198 unq 0 iso 0 dist 7.90031 7.21533 5.17341 6.74772 8.15936 8.16598 numMergedOcc 0
32 mol 198 unq 1 iso 0 dist 7.21533 7.90031 5.17341 6.74772 8.16598 8.15936 numMergedOcc 0
33 mol 213 unq 0 iso 0 dist 4.26212 6.68292 4.8814 5.90341 7.78247 10.7 numMergedOcc 0
34 mol 213 unq 1 iso 0 dist 4.26212 6.68292 4.8814 5.84474 7.37935 10.2818 numMergedOcc 0
35 mol 218 unq 0 iso 0 dist 7.18041 7.17547 9.17818 5.7776 6.86795 6.61099 numMergedOcc 0
36 mol 218 unq 1 iso 0 dist 7.18041 7.17547 9.17818 5.282 6.23898 11.1742 numMergedOcc 0
37 mol 218 unq 2 iso 0 dist 7.17547 7.18041 9.17818 10.3246 9.67381 13.5976 numMergedOcc 0
38 mol 218 unq 3 iso 0 dist 7.17547 7.18041 9.17818 5.7776 6.61099 6.86795 numMergedOcc 0
39 mol 218 unq 4 iso 0 dist 7.13323 9.50586 4.63933 9.8301 9.67381 14.2989 numMergedOcc 0
40 mol 218 unq 5 iso 0 dist 7.13323 9.50586 4.63933 9.97783 6.61099 10.4247 numMergedOcc 0
41 mol 227 unq 0 iso 0 dist 6.95902 9.62609 8.55671 7.22396 7.1372 10.841 numMergedOcc 0
42 mol 238 unq 0 iso 0 dist 6.55759 7.02475 6.44245 7.83352 8.6597 7.47235 numMergedOcc 0
43 mol 238 unq 1 iso 0 dist 6.55759 7.67322 10.677 7.83352 8.6597 10.3116 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 6.55759 7.19008 12.1411 7.83352 8.6597 6.44735 numMergedOcc 0
45 mol 238 unq 3 iso 0 dist 7.02475 6.55759 6.44245 7.83352 7.47235 8.6597 numMergedOcc 0
46 mol 238 unq 4 iso 0 dist 7.02475 7.67322 5.44694 7.83352 7.47235 10.3116 numMergedOcc 0
47 mol 238 unq 5 iso 0 dist 7.02475 7.19008 10.1756 7.83352 7.47235 6.44735 numMergedOcc 0
48 mol 238 unq 6 iso 0 dist 7.67322 6.55759 10.677 11.0349 7.61203 15.7712 numMergedOcc 0
49 mol 238 unq 7 iso 0 dist 7.67322 7.02475 5.44694 11.0349 7.61203 11.0295 numMergedOcc 0
50 mol 238 unq 8 iso 0 dist 7.67322 7.19008 9.50847 11.0349 7.61203 6.89694 numMergedOcc 0
51 mol 238 unq 9 iso 0 dist 9.68513 5.9216 4.83721 5.87253 9.47845 6.92409 numMergedOcc 0
52 mol 238 unq 10 iso 0 dist 5.9216 9.68513 4.83721 5.87253 6.92409 9.47845 numMergedOcc 0
53 mol 238 unq 11 iso 0 dist 7.19008 6.55759 12.1411 11.0349 6.89694 15.7712 numMergedOcc 0
54 mol 238 unq 12 iso 0 dist 7.19008 6.55759 12.1411 7.83352 6.44735 8.6597 numMergedOcc 0
55 mol 238 unq 13 iso 0 dist 7.19008 7.02475 10.1756 11.0349 6.89694 11.0295 numMergedOcc 0
56 mol 238 unq 14 iso 0 dist 7.19008 7.02475 10.1756 7.83352 6.44735 7.47235 numMergedOcc 0
57 mol 238 unq 15 iso 0 dist 7.19008 7.67322 9.50847 11.0349 6.89694 7.61203 numMergedOcc 0
58 mol 238 unq 16 iso 0 dist 7.19008 7.67322 9.50847 7.83352 6.44735 10.3116 numMergedOcc 0
59 mol 239 unq 0 iso 0 dist 7.39747 8.1777 4.89061 5.66732 7.18771 7.94894 numMergedOcc 0
60 mol 239 unq 1 iso 0 dist 8.1777 7.39747 4.89061 5.66732 7.94894 7.18771 numMergedOcc 0
61 mol 264 unq 0 iso 0 dist 9.5784 9.0012 6.20393 8.45726 6.5422 10.2204 numMergedOcc 0
62 mol 272 unq 0 iso 0 dist 6.16449 9.09992 9.75529 4.86504 7.55161 11.7075 numMergedOcc 0
