0 mol 51 unq 0 iso 0 dist 5.67627 5.46557 7.12423 5.44083 9.06397 10.8401 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 9.74289 10.1479 8.04256 12.791 6.87176 5.00567 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 9.74289 10.1479 8.04256 10.2048 5.57389 5.33771 numMergedOcc 0
3 mol 68 unq 2 iso 0 dist 9.74289 3.95228 7.51075 12.791 6.87176 12.5342 numMergedOcc 0
4 mol 68 unq 3 iso 0 dist 9.74289 3.95228 7.51075 10.2048 5.57389 9.21957 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 7.36475 5.94401 6.4551 8.53213 4.83274 4.00834 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 7.36475 5.94401 6.4551 5.28721 7.89214 9.6911 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 8.40871 11.8939 9.23023 15.4995 9.99029 5.00649 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 6.5136 11.2915 9.65047 7.53046 9.40559 15.0981 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 9.56095 10.1632 6.7973 4.62955 7.28355 6.12669 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 9.33638 16.7561 9.51764 4.51173 9.40003 18.2005 numMergedOcc 0
11 mol 214 unq 1 iso 0 dist 9.33638 16.7561 9.51764 16.1753 8.68385 4.74203 numMergedOcc 0
12 mol 214 unq 2 iso 0 dist 9.33638 5.24733 5.36829 4.51173 9.40003 4.87713 numMergedOcc 0
13 mol 214 unq 3 iso 0 dist 9.33638 5.24733 5.36829 16.1753 8.68385 13.4762 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 8.81925 9.27187 9.55777 11.7913 8.69148 12.6689 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 6.0087 13.2917 8.90987 15.6486 9.97357 7.84468 numMergedOcc 0
16 mol 253 unq 0 iso 0 dist 9.75753 12.1288 5.89502 12.5292 8.53729 7.60327 numMergedOcc 0
17 mol 253 unq 1 iso 0 dist 9.75753 12.1288 5.89502 8.23358 8.07341 9.90493 numMergedOcc 0
18 mol 253 unq 2 iso 0 dist 9.75753 15.7857 7.15815 12.5292 8.53729 13.127 numMergedOcc 0
19 mol 253 unq 3 iso 0 dist 9.75753 15.7857 7.15815 8.23358 8.07341 14.7487 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.66602 9.34577 6.83408 5.17977 6.80096 4.93509 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 9.60619 15.5414 7.74162 10.5154 5.17586 6.05412 numMergedOcc 0
