0 mol 61 unq 0 iso 0 dist 5.74014 9.33927 7.61513 9.43734 8.51839 3.30756 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 9.09269 11.5076 8.19721 7.49995 7.49792 4.29679 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.24862 10.9926 7.52742 9.56334 8.15861 7.14242 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 9.24862 10.9926 7.52742 11.5742 9.27814 15.6495 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 9.19143 11.9399 8.42914 9.65792 7.09177 6.21311 numMergedOcc 0
5 mol 91 unq 1 iso 0 dist 9.19143 14.4901 8.17327 9.65792 7.09177 7.17072 numMergedOcc 0
6 mol 91 unq 2 iso 0 dist 9.19143 15.0526 9.52936 9.65792 7.09177 10.0233 numMergedOcc 0
7 mol 91 unq 3 iso 0 dist 9.23907 15.5613 8.42914 11.3286 7.09177 6.21311 numMergedOcc 0
8 mol 91 unq 4 iso 0 dist 9.23907 16.4816 8.17327 11.3286 7.09177 7.17072 numMergedOcc 0
9 mol 91 unq 5 iso 0 dist 9.23907 18.1522 9.52936 11.3286 7.09177 10.0233 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 7.76517 8.66865 5.27541 12.542 8.61597 13.113 numMergedOcc 0
11 mol 96 unq 0 iso 0 dist 6.65816 6.63117 6.89038 4.51328 8.95766 4.81353 numMergedOcc 0
12 mol 96 unq 1 iso 0 dist 6.65816 6.63117 6.89038 4.89165 8.6548 6.0108 numMergedOcc 0
13 mol 104 unq 0 iso 0 dist 6.12716 9.22115 9.71834 9.01125 9.58427 4.07581 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 7.65424 12.8035 9.1717 6.0008 5.86693 6.8842 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 7.65424 9.85394 8.8319 6.0008 5.86693 5.05002 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 7.66242 14.0134 8.95504 4.99447 8.00223 12.7977 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 7.66242 14.0134 8.95504 5.46526 9.60695 12.1252 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 6.06892 10.5943 7.37431 8.98721 8.54982 4.26532 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 9.24924 16.0925 9.74822 8.2722 7.17276 9.8348 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 9.72248 15.535 9.74822 5.93642 7.17276 9.8348 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.80478 11.5033 5.06731 15.9206 8.15636 6.00938 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.80478 11.5033 5.06731 14.0034 7.86292 4.88961 numMergedOcc 0
23 mol 287 unq 2 iso 0 dist 9.22409 6.81421 5.06731 5.19316 8.15636 6.00938 numMergedOcc 0
24 mol 287 unq 3 iso 0 dist 9.22409 6.81421 5.06731 3.59476 7.86292 4.88961 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 7.80478 11.5033 5.06731 15.9206 8.15636 6.00938 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 7.80478 11.5033 5.06731 14.0034 7.86292 4.88961 numMergedOcc 0
27 mol 288 unq 2 iso 0 dist 9.22409 6.81421 5.06731 5.19316 8.15636 6.00938 numMergedOcc 0
28 mol 288 unq 3 iso 0 dist 9.22409 6.81421 5.06731 3.59476 7.86292 4.88961 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 7.80478 11.5033 5.06731 15.9206 8.15636 6.00938 numMergedOcc 0
30 mol 289 unq 1 iso 0 dist 7.80478 11.5033 5.06731 14.0034 7.86292 4.88961 numMergedOcc 0
31 mol 289 unq 2 iso 0 dist 9.22409 6.81421 5.06731 5.19316 8.15636 6.00938 numMergedOcc 0
32 mol 289 unq 3 iso 0 dist 9.22409 6.81421 5.06731 3.59476 7.86292 4.88961 numMergedOcc 0
