0 mol 25 unq 0 iso 0 dist 9.03281 5.03904 9.94577 8.46842 9.36442 4.79873 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 6.70575 6.15452 8.62204 4.82342 5.39129 9.19165 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.56621 5.37144 6.37273 13.3899 8.66168 9.8703 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 8.56621 5.37144 6.37273 9.74289 7.1369 7.39665 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 8.11268 3.53164 9.86502 7.09258 7.06403 7.66093 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.9053 4.05111 9.3711 11.415 14.388 8.23026 numMergedOcc 0
6 mol 105 unq 0 iso 0 dist 9.98129 6.52143 9.11206 13.4986 7.16724 9.16718 numMergedOcc 0
7 mol 105 unq 1 iso 0 dist 9.98129 6.52143 9.11206 10.401 7.70748 7.94633 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 9.61775 4.89918 8.21936 11.0363 9.20754 7.18002 numMergedOcc 0
9 mol 170 unq 0 iso 0 dist 7.70662 5.03025 8.95292 7.665 8.83341 9.08274 numMergedOcc 0
10 mol 170 unq 1 iso 0 dist 7.70662 5.03025 8.95292 12.2299 11.2005 9.51256 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.55517 13.2928 9.82338 18.0939 9.653 8.90571 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 9.55517 13.2928 9.82338 16.0845 10.568 6.61112 numMergedOcc 0
13 mol 211 unq 0 iso 0 dist 7.03051 4.80633 6.69877 7.66285 6.13472 6.28595 numMergedOcc 0
14 mol 211 unq 1 iso 0 dist 5.97292 5.39243 6.69877 9.46404 6.13472 6.28595 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 5.50501 7.15922 6.92437 6.67907 5.74377 8.23087 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.36178 8.57494 6.64008 14.1009 11.4465 6.73665 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 6.36178 8.57494 6.64008 11.0354 5.08687 9.34438 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 6.36178 8.57494 6.64008 17.2289 12.4215 9.35949 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 9.19372 8.3996 4.54745 11.0373 5.26867 7.15764 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 6.82161 9.94726 5.81865 6.50405 5.86413 8.83833 numMergedOcc 0
21 mol 257 unq 1 iso 0 dist 5.97154 7.85199 5.81865 11.502 5.86413 8.83833 numMergedOcc 0
22 mol 257 unq 2 iso 0 dist 8.4903 12.5937 5.81865 13.4337 5.86413 8.83833 numMergedOcc 0
23 mol 257 unq 3 iso 0 dist 8.04644 10.4413 5.81865 13.7377 5.86413 8.83833 numMergedOcc 0
