0 mol 30 unq 0 iso 0 dist 7.53042 8.94022 6.10646 8.34136 6.07517 11.7486 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 5.00126 9.70029 7.401 7.71511 8.70192 11.3405 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.41567 4.73362 4.85247 6.65453 6.72869 7.46095 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 8.41567 9.61367 12.7241 6.65453 6.72869 13.8179 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 5.56964 4.73362 6.45686 6.65453 9.85905 7.46095 numMergedOcc 0
5 mol 76 unq 3 iso 0 dist 5.56964 9.61367 4.3931 6.65453 9.85905 13.8179 numMergedOcc 0
6 mol 76 unq 4 iso 0 dist 6.62246 7.3795 4.85247 7.15288 6.72869 7.46095 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 8.22596 9.66995 4.86592 12.9651 9.90751 13.9158 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 8.22596 9.66995 4.86592 13.0711 9.21662 11.1692 numMergedOcc 0
9 mol 100 unq 2 iso 0 dist 9.56324 6.36749 9.75737 15.353 7.82475 17.2742 numMergedOcc 0
10 mol 100 unq 3 iso 0 dist 9.56324 6.36749 9.75737 12.9628 5.35782 14.2997 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 8.46796 8.71549 5.8736 8.53742 7.37333 12.2437 numMergedOcc 0
12 mol 162 unq 1 iso 0 dist 8.46796 8.71549 5.8736 11.0013 7.45998 13.1079 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 8.90247 9.99409 8.91338 11.9701 9.76212 17.8171 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.58792 9.99409 11.85 11.9701 8.59874 17.8171 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 8.96639 8.52162 13.49 9.54858 8.82351 17.6299 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.83046 9.25097 9.59042 8.15025 6.73665 10.8822 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 8.98668 9.14228 4.90279 5.65355 7.95042 10.8022 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 6.8902 6.12402 5.24812 9.58347 8.29262 11.9497 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 8.68797 5.21664 12.6502 5.03816 6.35028 7.17958 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 5.70546 8.6522 12.6264 6.39046 7.24366 14.8522 numMergedOcc 0
