0 mol 9 unq 0 iso 0 dist 8.77074 14.7962 8.69493 11.1857 8.55446 5.54438 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.77074 14.7962 8.69493 9.93406 6.59455 6.57322 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.77074 14.7962 8.69493 13.0985 5.71201 7.5263 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.77074 15.5258 7.02963 11.1857 8.55446 9.91187 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 8.77074 15.5258 7.02963 9.93406 6.59455 9.06833 numMergedOcc 0
5 mol 9 unq 5 iso 0 dist 8.77074 15.5258 7.02963 13.0985 5.71201 5.38864 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 7.27883 6.23608 4.75558 9.02863 6.15801 9.05396 numMergedOcc 0
7 mol 34 unq 1 iso 0 dist 7.27883 6.23608 4.75558 12.015 9.63403 9.98702 numMergedOcc 0
8 mol 34 unq 2 iso 0 dist 7.27883 6.23608 4.75558 4.1203 8.07314 4.78533 numMergedOcc 0
9 mol 44 unq 0 iso 0 dist 7.03812 14.5957 8.6578 10.0797 7.03307 6.30672 numMergedOcc 0
10 mol 44 unq 1 iso 0 dist 7.03812 14.5957 8.6578 6.29545 7.25707 10.7753 numMergedOcc 0
11 mol 63 unq 0 iso 0 dist 5.9644 4.55823 8.34374 3.72318 5.53589 7.25012 numMergedOcc 0
12 mol 68 unq 0 iso 0 dist 5.74389 12.3008 8.8466 6.32283 6.40693 6.99666 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 6.53468 5.48316 9.23537 4.79924 7.62738 5.00897 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 5.90954 8.01468 9.23537 9.80492 7.62738 5.00897 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 6.1835 4.46648 9.09364 6.49348 7.12072 6.25204 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 5.33314 6.87651 7.5344 7.57827 8.92828 11.4585 numMergedOcc 0
17 mol 131 unq 1 iso 0 dist 5.33314 6.87651 7.5344 3.98821 5.56627 6.14427 numMergedOcc 0
18 mol 131 unq 2 iso 0 dist 7.27702 6.68239 9.77097 4.34786 6.48674 4.17212 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 9.08628 6.57343 5.32236 9.7676 8.05247 5.86269 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 9.08628 6.57343 5.32236 11.4159 9.71028 10.5222 numMergedOcc 0
21 mol 175 unq 2 iso 0 dist 8.35581 4.85698 5.32236 5.81984 8.05247 5.86269 numMergedOcc 0
22 mol 175 unq 3 iso 0 dist 8.35581 4.85698 5.32236 12.3602 9.71028 10.5222 numMergedOcc 0
23 mol 175 unq 4 iso 0 dist 6.72569 5.60933 5.32236 3.98834 8.05247 5.86269 numMergedOcc 0
24 mol 175 unq 5 iso 0 dist 6.72569 5.60933 5.32236 9.4225 9.71028 10.5222 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 7.47107 12.2364 9.13708 10.7677 5.68348 13.9769 numMergedOcc 0
26 mol 218 unq 0 iso 0 dist 9.6309 5.61487 9.71415 10.2441 9.32945 14.3098 numMergedOcc 0
27 mol 220 unq 0 iso 0 dist 5.31079 10.9196 6.648 6.5238 6.51288 7.31769 numMergedOcc 0
28 mol 237 unq 0 iso 0 dist 8.06435 6.26246 9.82325 3.96327 5.6703 8.50643 numMergedOcc 0
29 mol 237 unq 1 iso 0 dist 8.06435 6.26246 9.82325 9.75157 8.72819 13.9178 numMergedOcc 0
30 mol 266 unq 0 iso 0 dist 9.39659 7.00525 8.7324 6.00136 9.53943 8.19557 numMergedOcc 0
31 mol 272 unq 0 iso 0 dist 8.36282 5.50225 6.49719 10.2848 9.18635 7.70017 numMergedOcc 0
32 mol 272 unq 1 iso 0 dist 8.36282 9.7581 5.7564 10.2848 9.18635 4.49628 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 5.63154 13.0129 7.92537 11.7377 9.30921 8.23428 numMergedOcc 0
