0 mol 60 unq 0 iso 0 dist 5.83937 6.36945 4.32336 6.62193 6.65595 10.3081 numMergedOcc 0
1 mol 60 unq 1 iso 0 dist 5.83937 6.36945 4.32336 10.9885 9.25011 13.4885 numMergedOcc 0
2 mol 60 unq 2 iso 0 dist 5.83937 6.36945 4.32336 9.96073 6.43294 7.77255 numMergedOcc 0
3 mol 60 unq 3 iso 0 dist 5.83937 6.36945 4.32336 11.2445 8.52121 11.6961 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 7.83619 9.15278 14.308 10.0837 9.28393 17.4351 numMergedOcc 0
5 mol 130 unq 1 iso 0 dist 7.83619 9.05561 13.1903 10.0837 9.28393 18.2583 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.78849 7.59996 6.70411 11.454 9.89303 11.5755 numMergedOcc 0
7 mol 142 unq 0 iso 0 dist 7.57458 6.00045 6.05056 13.1936 9.2313 10.1107 numMergedOcc 0
8 mol 142 unq 1 iso 0 dist 7.57458 6.00045 6.05056 12.288 7.73169 11.3512 numMergedOcc 0
9 mol 142 unq 2 iso 0 dist 7.57458 6.00045 6.05056 14.2067 8.96657 14.5043 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.74498 9.61301 13.3193 10.7816 8.67331 13.9586 numMergedOcc 0
11 mol 152 unq 1 iso 0 dist 9.74498 9.61301 13.3193 7.26476 8.05741 14.1959 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 8.69888 8.9395 12.4148 11.5099 9.0018 14.9267 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 8.69888 8.9395 12.4148 5.50014 5.6234 10.2436 numMergedOcc 0
14 mol 175 unq 2 iso 0 dist 8.69888 8.9395 12.4148 7.39186 6.57069 14.8913 numMergedOcc 0
15 mol 175 unq 3 iso 0 dist 5.08206 9.25721 9.04495 12.1783 9.0018 17.7813 numMergedOcc 0
16 mol 175 unq 4 iso 0 dist 5.08206 9.25721 9.04495 7.28617 5.6234 13.3663 numMergedOcc 0
17 mol 175 unq 5 iso 0 dist 5.08206 9.25721 9.04495 5.77256 6.57069 14.4011 numMergedOcc 0
18 mol 180 unq 0 iso 0 dist 8.44989 7.95427 3.5929 9.76368 9.62337 11.4978 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 7.86625 9.72584 3.8657 5.40949 9.31746 11.7478 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 9.67457 8.78286 17.8124 5.82028 6.18308 13.451 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 8.49704 5.10016 10.2428 12.4611 9.65138 14.454 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 8.49704 5.10016 10.2428 11.832 7.14453 15.5922 numMergedOcc 0
23 mol 214 unq 2 iso 0 dist 8.49704 5.10016 10.2428 10.644 8.85478 11.1906 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.7347 9.77756 13.2353 8.81265 6.00706 16.8453 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 8.7347 9.77756 13.2353 4.28891 7.54212 11.5798 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 6.77279 7.94491 4.51538 7.55268 8.53687 9.35823 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 6.77279 7.94491 4.51538 5.71237 8.13497 11.5243 numMergedOcc 0
28 mol 259 unq 2 iso 0 dist 9.58006 7.94491 9.08426 5.71237 7.88519 11.5243 numMergedOcc 0
29 mol 259 unq 3 iso 0 dist 9.58006 7.94491 9.08426 9.10984 7.84554 13.9766 numMergedOcc 0
30 mol 259 unq 4 iso 0 dist 9.58006 7.94491 9.08426 11.8501 7.46176 14.5075 numMergedOcc 0
31 mol 259 unq 5 iso 0 dist 9.58006 7.94491 9.08426 13.9868 9.18903 16.8508 numMergedOcc 0
32 mol 282 unq 0 iso 0 dist 5.67266 8.69145 10.3469 9.63727 8.04483 17.2288 numMergedOcc 0
33 mol 282 unq 1 iso 0 dist 5.67266 8.69145 10.3469 4.58403 8.76532 10.4729 numMergedOcc 0
34 mol 282 unq 2 iso 0 dist 5.67266 8.69145 10.3469 5.04235 6.33524 12.7604 numMergedOcc 0
