0 mol 7 unq 0 iso 0 dist 8.88982 9.49401 6.34041 16.991 9.67164 10.3333 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.99509 9.9451 10.7805 11.0512 6.66407 13.7086 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.63534 9.2958 6.45686 10.4541 9.85905 7.46095 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.63534 8.23534 4.3931 10.4541 9.85905 13.8179 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.79726 6.9297 6.79583 3.89377 9.76379 7.43127 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 6.5258 5.93497 5.76098 4.03471 4.22363 5.36587 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.22628 9.19273 6.40494 3.82475 6.39384 10.2171 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 8.16369 7.77211 14.8119 14.8867 8.73533 22.4176 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 6.73266 9.639 5.86489 13.3588 7.9133 9.48625 numMergedOcc 0
9 mol 234 unq 0 iso 0 dist 4.91961 9.33455 10.0059 4.84686 7.81215 7.77911 numMergedOcc 0
10 mol 234 unq 1 iso 0 dist 7.14333 9.33455 5.08515 4.84686 5.64285 7.77911 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 5.99137 7.87572 13.1168 13.9834 9.3206 19.3728 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 6.92721 9.26512 11.169 3.45727 6.73665 8.95511 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 6.92721 9.2495 9.59042 3.45727 6.73665 10.8822 numMergedOcc 0
14 mol 239 unq 2 iso 0 dist 6.92721 5.82804 5.88931 3.45727 6.73665 5.85002 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 6.97756 9.36895 4.90279 4.63415 7.95042 10.8022 numMergedOcc 0
16 mol 267 unq 0 iso 0 dist 6.19138 8.22601 5.89182 6.43871 7.34981 10.8095 numMergedOcc 0
17 mol 267 unq 1 iso 0 dist 6.19138 6.55433 8.37094 6.43871 7.34981 6.27154 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.64889 9.7625 7.70529 5.36788 9.35539 12.9467 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 9.64889 9.7625 7.70529 15.23 8.9682 9.26157 numMergedOcc 0
20 mol 277 unq 2 iso 0 dist 9.64889 9.7625 7.70529 15.0167 6.92711 9.11117 numMergedOcc 0
