0 mol 11 unq 0 iso 0 dist 9.07476 6.65725 4.79838 9.36527 9.81983 7.5901 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 7.06029 11.9573 9.11491 6.04435 6.86517 6.49291 numMergedOcc 0
2 mol 79 unq 1 iso 0 dist 7.06029 11.9573 9.11491 12.3232 8.33791 7.82761 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 6.10053 4.97513 6.18681 6.66441 8.61893 4.48233 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 6.67863 9.59696 8.35515 5.08458 9.44645 7.83985 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 8.50194 4.6158 6.28029 5.57288 8.58308 4.94926 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 8.24233 5.79458 6.28029 10.5065 8.58308 4.94926 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 7.93106 4.12495 8.86956 9.8725 8.98175 6.6028 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 7.04904 8.39839 8.86956 7.03404 8.98175 6.6028 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 8.76449 4.30798 9.23589 7.38323 9.59327 4.42975 numMergedOcc 0
10 mol 147 unq 1 iso 0 dist 8.36182 4.30798 9.22196 7.38323 8.51399 4.42975 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 8.26128 6.28784 5.97134 10.3128 8.90588 4.70993 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 8.17301 4.48609 7.61421 5.18154 9.20617 6.03415 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 8.87165 15.2718 7.74029 4.8012 5.59832 11.9538 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 8.87165 15.2718 7.74029 16.5446 9.17562 10.5686 numMergedOcc 0
15 mol 254 unq 0 iso 0 dist 7.89302 5.11145 6.59989 5.58669 9.31434 8.57314 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 9.82713 5.95459 9.85661 5.15747 8.09181 4.60275 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.24013 4.29127 8.13595 4.60075 6.23115 5.7252 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 6.82918 13.607 9.94612 10.5882 6.18742 14.9634 numMergedOcc 0
19 mol 286 unq 0 iso 0 dist 8.87916 8.56408 9.81574 4.08297 9.21276 9.29057 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 7.84189 4.26276 5.50067 4.15763 8.58427 5.13166 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.84189 4.26276 5.50067 4.15763 8.58427 5.13166 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 7.84189 4.26276 5.50067 4.15763 8.58427 5.13166 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 8.85506 11.4817 9.10627 7.1944 5.91617 9.06235 numMergedOcc 0
