0 mol 27 unq 0 iso 0 dist 9.76721 7.96851 9.52155 9.19658 3.71141 9.58751 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 8.26289 3.94866 5.31095 10.5007 5.20813 8.50375 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 7.11102 3.97946 6.28905 5.67098 4.30611 5.42296 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 8.48054 7.82134 6.28905 8.58218 4.30611 5.42296 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.11934 4.82623 6.10199 8.17564 10.9396 7.92479 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 9.64544 9.79765 9.33968 9.30724 3.96397 6.18681 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.43487 7.32784 6.13175 11.4507 3.85992 5.45882 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 9.43487 8.46561 4.34107 11.4507 3.85992 4.57487 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 9.97052 11.9142 6.13175 13.2053 3.85992 5.45882 numMergedOcc 0
9 mol 113 unq 3 iso 0 dist 9.97052 9.75283 4.34107 13.2053 3.85992 4.57487 numMergedOcc 0
10 mol 113 unq 4 iso 0 dist 7.3324 8.67805 6.13175 5.44714 3.85992 5.45882 numMergedOcc 0
11 mol 113 unq 5 iso 0 dist 7.3324 6.03962 4.34107 5.44714 3.85992 4.57487 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 6.8458 5.21212 5.45716 7.25217 5.27716 8.61909 numMergedOcc 0
13 mol 114 unq 1 iso 0 dist 6.8458 5.21212 5.45716 9.97958 9.94896 5.96977 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 9.67328 9.74857 9.66947 7.31632 6.30764 9.81165 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 9.67328 5.83113 5.69652 7.31632 6.30764 7.74029 numMergedOcc 0
16 mol 254 unq 0 iso 0 dist 8.83523 5.81468 5.44351 10.3381 5.88488 7.23916 numMergedOcc 0
17 mol 254 unq 1 iso 0 dist 8.83523 8.51317 6.34051 10.3381 5.88488 6.12653 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 5.56721 4.20802 6.12608 12.2739 12.0153 8.13595 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 7.81415 15.5185 9.74797 11.5064 9.22715 9.06774 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 7.81415 6.35533 9.90494 11.5064 9.22715 7.83424 numMergedOcc 0
21 mol 286 unq 0 iso 0 dist 9.96295 8.1401 6.87255 17.5794 10.5287 9.81574 numMergedOcc 0
22 mol 286 unq 1 iso 0 dist 8.95266 9.30848 6.87255 12.2509 10.5287 9.81574 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 6.08044 7.11108 8.70479 10.6734 6.53691 9.53713 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 8.8956 13.1778 8.70479 14.6962 6.53691 9.53713 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 6.08044 7.11108 8.70479 10.6734 6.53691 9.53713 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 8.8956 13.1778 8.70479 14.6962 6.53691 9.53713 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 6.08044 7.11108 8.70479 10.6734 6.53691 9.53713 numMergedOcc 0
28 mol 289 unq 1 iso 0 dist 8.8956 13.1778 8.70479 14.6962 6.53691 9.53713 numMergedOcc 0
