0 mol 19 unq 0 iso 0 dist 8.19695 4.01494 6.41656 7.02548 6.60936 8.54034 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.02548 4.01494 8.54034 8.19695 6.60936 6.41656 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 6.42834 9.95354 6.21128 9.12422 6.79252 9.57024 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 7.87237 5.72646 9.09458 11.031 7.21092 8.02443 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 6.0652 6.13211 6.55173 9.44658 4.36434 6.59691 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 7.12936 7.43379 7.17599 10.2898 6.35752 7.28318 numMergedOcc 0
6 mol 135 unq 1 iso 0 dist 9.15377 9.89298 7.28318 12.128 6.35752 7.17599 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 5.26989 4.22522 5.29898 9.40594 6.51325 5.92302 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 6.97487 5.43382 5.06564 10.3291 4.30566 7.5373 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 6.46089 4.38322 5.06564 10.1154 4.30566 7.5373 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 9.80845 4.48516 9.16358 7.55196 6.56063 9.24038 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 9.0529 12.0485 9.24038 13.3276 6.56063 9.16358 numMergedOcc 0
12 mol 155 unq 2 iso 0 dist 7.55196 4.48516 9.24038 9.80845 6.56063 9.16358 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.32777 5.82396 9.88897 11.5642 9.87773 9.06571 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 5.97685 10.2172 9.43306 13.5221 9.53592 8.4848 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 8.9289 14.2334 9.43306 14.5372 9.53592 8.4848 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 7.73748 6.24324 7.7086 10.8228 5.51027 6.94762 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 7.57454 4.09934 8.91971 12.2922 11.362 9.18728 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.85779 4.42663 5.61969 12.753 4.4844 9.0277 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 7.48235 4.52322 7.67837 11.3284 12.8994 9.03998 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.24367 10.5027 9.42255 18.1643 13.3172 8.98854 numMergedOcc 0
