0 mol 8 unq 0 iso 0 dist 9.95165 6.88402 8.94096 16.9034 8.77457 12.7056 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.95165 9.96761 9.07858 16.9034 8.77457 16.8602 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 4.61828 8.91397 8.62284 10.7574 9.69752 5.90981 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 4.61828 8.91397 8.62284 12.8157 9.36461 13.719 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.93801 10.7786 8.42581 7.46244 6.74848 11.553 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.73842 9.20722 8.06525 14.9324 9.35942 9.47219 numMergedOcc 0
6 mol 158 unq 0 iso 0 dist 7.24115 8.52244 6.39981 9.21335 6.76055 5.42969 numMergedOcc 0
7 mol 158 unq 1 iso 0 dist 7.24115 8.52244 6.39981 13.1807 9.36343 4.77562 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 6.96572 5.80695 5.92747 9.55101 7.8639 6.84883 numMergedOcc 0
9 mol 163 unq 1 iso 0 dist 9.29539 13.2873 8.21476 15.8699 9.79069 15.4471 numMergedOcc 0
10 mol 163 unq 2 iso 0 dist 9.29539 13.2873 8.21476 6.48748 9.27496 9.33755 numMergedOcc 0
11 mol 163 unq 3 iso 0 dist 9.29539 14.4829 7.66897 15.8699 9.79069 9.54216 numMergedOcc 0
12 mol 163 unq 4 iso 0 dist 9.29539 14.4829 7.66897 6.48748 9.27496 10.7572 numMergedOcc 0
13 mol 163 unq 5 iso 0 dist 9.02124 10.4425 8.21476 17.0667 9.79069 15.4471 numMergedOcc 0
14 mol 163 unq 6 iso 0 dist 9.02124 10.4425 8.21476 15.7737 9.27496 9.33755 numMergedOcc 0
15 mol 163 unq 7 iso 0 dist 9.02124 13.7217 7.66897 17.0667 9.79069 9.54216 numMergedOcc 0
16 mol 163 unq 8 iso 0 dist 9.02124 13.7217 7.66897 15.7737 9.27496 10.7572 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 8.63008 8.91682 9.77862 4.44921 5.68348 5.63279 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 9.05206 15.4215 6.4829 11.9731 5.57779 5.96222 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 9.05206 15.4215 6.4829 10.4089 7.05649 10.1011 numMergedOcc 0
20 mol 210 unq 2 iso 0 dist 9.05206 15.4215 6.4829 4.78637 6.78579 12.5026 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 8.768 13.2718 5.13453 12.7912 8.20162 6.16433 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 8.54245 5.83664 6.01071 9.97818 7.44706 4.78857 numMergedOcc 0
23 mol 250 unq 0 iso 0 dist 5.43238 7.01289 9.03319 4.45246 5.93798 4.45194 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 7.11691 10.3424 7.55161 8.64133 9.18635 12.015 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 8.84798 14.1561 8.23056 10.8394 9.30921 6.29016 numMergedOcc 0
26 mol 284 unq 0 iso 0 dist 5.68818 9.65436 8.27054 7.98227 9.63007 5.39591 numMergedOcc 0
