0 mol 8 unq 0 iso 0 dist 9.73496 8.82216 8.80278 5.53899 9.36839 4.35292 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.96502 8.43775 9.72716 5.25196 8.30431 6.27103 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 7.96502 8.43775 9.72716 6.97911 4.628 6.86236 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.16791 9.91575 8.44753 15.4318 7.09393 9.5091 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 9.16791 9.91575 8.44753 11.6163 3.87167 6.88345 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 6.57452 6.39837 7.33546 11.6815 9.22636 7.83359 numMergedOcc 0
6 mol 86 unq 0 iso 0 dist 8.45341 11.4158 7.18799 5.16705 9.62655 8.79483 numMergedOcc 0
7 mol 86 unq 1 iso 0 dist 8.45341 9.68657 8.4254 5.16705 9.62655 8.47281 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 6.7095 10.2573 6.37194 13.457 8.63522 6.44938 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 6.7095 10.2573 6.37194 10.8385 5.43401 6.57608 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 5.8915 9.17593 8.70106 8.5691 7.81042 11.4822 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 6.15949 8.20626 5.66196 5.67441 5.31281 5.6579 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 6.15949 8.20626 5.66196 10.0602 8.9922 4.77912 numMergedOcc 0
13 mol 114 unq 2 iso 0 dist 6.79014 9.85586 9.15982 4.97361 9.6874 14.0132 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 7.11102 7.91188 7.82151 15.1019 9.95726 9.05726 numMergedOcc 0
15 mol 126 unq 0 iso 0 dist 9.40595 12.7248 7.80819 14.8513 7.25133 4.30864 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 6.4413 8.90222 5.86949 13.2694 9.71692 6.33907 numMergedOcc 0
17 mol 148 unq 1 iso 0 dist 6.4413 11.3382 6.72591 13.2694 9.71692 7.50382 numMergedOcc 0
18 mol 150 unq 0 iso 0 dist 6.62609 8.93873 5.84971 13.3379 9.73708 6.43607 numMergedOcc 0
19 mol 150 unq 1 iso 0 dist 6.62609 11.5334 6.80192 13.3379 9.73708 7.48524 numMergedOcc 0
20 mol 189 unq 0 iso 0 dist 6.77351 10.3814 8.81184 6.32602 8.23197 12.7403 numMergedOcc 0
21 mol 189 unq 1 iso 0 dist 8.4676 16.383 8.81184 9.84174 8.23197 12.7403 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 5.99718 4.55979 7.42784 9.55761 8.23246 10.5635 numMergedOcc 0
23 mol 220 unq 1 iso 0 dist 5.99718 6.35303 6.11123 9.55761 8.23246 4.84006 numMergedOcc 0
24 mol 226 unq 0 iso 0 dist 6.3687 7.95454 7.6174 12.3798 7.20862 8.00807 numMergedOcc 0
25 mol 227 unq 0 iso 0 dist 8.32703 12.1436 9.09371 5.55239 5.2851 9.22288 numMergedOcc 0
26 mol 227 unq 1 iso 0 dist 8.25412 14.3715 9.09371 5.34424 5.2851 9.22288 numMergedOcc 0
27 mol 245 unq 0 iso 0 dist 8.03294 11.3485 7.1207 6.5213 7.26913 5.75694 numMergedOcc 0
28 mol 245 unq 1 iso 0 dist 8.03294 11.3485 7.1207 13.9182 6.41862 6.87827 numMergedOcc 0
29 mol 245 unq 2 iso 0 dist 8.03294 11.3485 7.1207 13.8285 8.69377 9.93908 numMergedOcc 0
30 mol 260 unq 0 iso 0 dist 7.95918 9.01244 9.94532 4.96171 8.13696 5.75427 numMergedOcc 0
31 mol 279 unq 0 iso 0 dist 6.85288 5.00251 5.00402 11.71 9.98985 10.1637 numMergedOcc 0
32 mol 279 unq 1 iso 0 dist 6.85288 5.00251 5.00402 10.2918 7.22295 5.61514 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 8.80626 9.56395 4.66252 10.6818 4.49185 5.44878 numMergedOcc 0
34 mol 288 unq 0 iso 0 dist 8.80626 9.56395 4.66252 10.6818 4.49185 5.44878 numMergedOcc 0
35 mol 289 unq 0 iso 0 dist 8.80626 9.56395 4.66252 10.6818 4.49185 5.44878 numMergedOcc 0
