0 mol 41 unq 0 iso 0 dist 5.36895 4.29713 7.18662 6.74659 9.72273 5.95472 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.06275 8.74209 5.41726 4.63315 10.0804 8.21247 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.72872 7.72041 4.02037 5.56571 9.20429 8.73588 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 6.81152 8.3736 9.9157 10.4345 16.0313 8.95123 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.9651 6.09085 7.50975 8.88456 9.40333 7.50377 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 9.42271 7.76446 15.9138 16.0346 22.5727 8.73668 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 5.21803 9.71155 5.65603 5.58809 7.69229 9.65468 numMergedOcc 0
7 mol 195 unq 0 iso 0 dist 4.78641 6.27266 5.41635 13.3463 10.999 9.20541 numMergedOcc 0
8 mol 217 unq 0 iso 0 dist 7.58097 9.41353 13.1665 11.8565 17.8109 7.00456 numMergedOcc 0
9 mol 217 unq 1 iso 0 dist 7.58097 8.28155 13.7271 11.8565 17.8109 8.99484 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 6.32302 6.92268 4.17276 5.19315 10.7513 9.60329 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 6.88694 6.92268 4.92403 5.19315 8.83023 9.60329 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 8.95071 5.9625 10.5937 5.81446 5.90804 8.75172 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 7.151 9.22453 11.2997 10.2688 14.8509 6.42951 numMergedOcc 0
14 mol 277 unq 1 iso 0 dist 8.53324 9.22453 4.40029 10.2688 9.92831 6.42951 numMergedOcc 0
15 mol 277 unq 2 iso 0 dist 7.23956 9.22453 3.97543 10.2688 4.81916 6.42951 numMergedOcc 0
