0 mol 32 unq 0 iso 0 dist 9.2795 12.0617 6.89423 5.59084 5.9972 7.96047 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 8.9353 9.36247 7.90158 5.27874 7.23219 7.11442 numMergedOcc 0
2 mol 36 unq 1 iso 0 dist 5.58536 6.66044 7.90158 5.82778 7.23219 7.11442 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 7.18148 3.80217 7.62814 14.234 9.03391 14.9303 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 6.0662 3.62253 8.57935 6.17111 9.12096 7.60846 numMergedOcc 0
5 mol 99 unq 0 iso 0 dist 5.43108 8.60493 6.55815 5.99547 5.81267 4.96065 numMergedOcc 0
6 mol 99 unq 1 iso 0 dist 5.43108 8.60493 6.55815 7.07694 9.23584 10.8453 numMergedOcc 0
7 mol 99 unq 2 iso 0 dist 5.43108 8.60493 6.55815 5.22642 9.10744 8.56161 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 5.35509 6.1421 4.93944 9.31967 6.50336 11.2477 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 4.88625 5.784 4.68068 4.64868 8.40257 7.04473 numMergedOcc 0
10 mol 212 unq 0 iso 0 dist 8.69747 6.99412 6.47726 3.92115 6.07371 4.91427 numMergedOcc 0
11 mol 287 unq 0 iso 0 dist 8.08382 13.9974 7.29668 9.81184 5.50067 6.29848 numMergedOcc 0
12 mol 288 unq 0 iso 0 dist 8.08382 13.9974 7.29668 9.81184 5.50067 6.29848 numMergedOcc 0
13 mol 289 unq 0 iso 0 dist 8.08382 13.9974 7.29668 9.81184 5.50067 6.29848 numMergedOcc 0
