0 mol 5 unq 0 iso 0 dist 7.47183 6.54476 4.21127 3.85353 7.95876 4.98321 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 7.60252 9.09488 4.03844 8.34938 7.12321 10.9996 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.4804 8.28542 5.31985 9.23259 6.72869 9.59729 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.4804 9.19184 4.76 9.23259 6.72869 10.871 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 9.19402 8.06915 13.2174 15.1746 9.13322 20.7779 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.09482 9.46118 9.50063 5.64102 7.13008 8.89015 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 6.12086 9.13688 5.06946 14.1258 8.27883 9.9573 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 6.12086 9.13688 5.06946 9.66145 5.75428 10.0817 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 6.12086 9.13688 5.06946 9.58465 8.57395 11.7225 numMergedOcc 0
9 mol 95 unq 3 iso 0 dist 6.12086 9.13688 5.06946 4.62357 9.85409 12.4057 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 5.8729 7.47769 5.00433 10.2645 7.07971 9.09348 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 5.94669 7.77481 6.9791 8.30405 6.00603 12.1654 numMergedOcc 0
12 mol 142 unq 0 iso 0 dist 6.90378 9.70331 5.36827 9.67929 7.81207 8.76554 numMergedOcc 0
13 mol 142 unq 1 iso 0 dist 6.90378 9.70331 5.36827 6.32951 7.18002 11.4032 numMergedOcc 0
14 mol 142 unq 2 iso 0 dist 7.01955 9.70331 4.00457 9.67929 6.14151 8.76554 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 5.39213 8.42099 11.5563 10.6602 8.73533 18.9351 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.07855 5.51962 8.81358 11.2726 5.85442 13.3349 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 9.07855 5.51962 8.81358 9.26271 6.95511 12.5623 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 8.61945 8.7538 3.97543 12.6855 9.35539 13.0595 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 8.61945 8.7538 3.97543 15.9144 8.9682 7.16209 numMergedOcc 0
20 mol 277 unq 2 iso 0 dist 8.61945 8.7538 3.97543 13.156 6.92711 4.62936 numMergedOcc 0
