0 mol 120 unq 0 iso 0 dist 9.18835 5.12002 10.1606 3.79204 9.74582 8.88848 numMergedOcc 0
1 mol 120 unq 1 iso 0 dist 9.18835 8.46914 5.30162 3.79204 9.74582 10.9097 numMergedOcc 0
2 mol 126 unq 0 iso 0 dist 7.25133 6.62527 11.5654 11.2933 9.55276 16.7148 numMergedOcc 0
3 mol 171 unq 0 iso 0 dist 9.47945 6.4751 15.864 6.8538 8.95953 11.6947 numMergedOcc 0
4 mol 171 unq 1 iso 0 dist 9.47945 5.75085 14.3848 6.8538 8.95953 12.2237 numMergedOcc 0
5 mol 220 unq 0 iso 0 dist 7.86207 7.46122 4.39102 6.68491 8.40945 4.54224 numMergedOcc 0
6 mol 220 unq 1 iso 0 dist 7.86207 7.46122 4.39102 8.20682 7.81237 10.6444 numMergedOcc 0
7 mol 236 unq 0 iso 0 dist 7.6402 8.88405 8.43621 6.93622 9.41513 11.1067 numMergedOcc 0
8 mol 236 unq 1 iso 0 dist 7.6402 7.13854 6.96377 6.93622 9.41513 12.4566 numMergedOcc 0
9 mol 239 unq 0 iso 0 dist 7.21466 9.85821 11.3034 6.18958 8.39251 5.95622 numMergedOcc 0
10 mol 241 unq 0 iso 0 dist 9.99337 9.30143 9.37079 11.0006 8.86734 14.2315 numMergedOcc 0
11 mol 244 unq 0 iso 0 dist 6.51428 9.97458 16.0237 9.74679 8.95246 18.7596 numMergedOcc 0
12 mol 244 unq 1 iso 0 dist 6.51428 9.97458 16.0237 5.65728 5.97452 12.0059 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 8.42706 9.54381 15.3099 11.4451 9.64978 20.8936 numMergedOcc 0
14 mol 268 unq 0 iso 0 dist 6.74419 7.40731 5.28541 7.79979 5.46063 9.47433 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 6.44266 9.35929 10.3973 8.2168 7.32898 15.824 numMergedOcc 0
16 mol 274 unq 1 iso 0 dist 8.75703 9.35929 5.43792 14.0477 9.32156 14.6144 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.57035 9.24164 9.43169 7.77606 7.08788 8.07169 numMergedOcc 0
18 mol 280 unq 0 iso 0 dist 7.02503 9.38952 11.9041 9.29964 9.93207 17.9494 numMergedOcc 0
