0 mol 14 unq 0 iso 0 dist 6.11408 5.80918 8.51178 4.2668 7.5313 7.18054 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 6.11408 8.39619 7.04966 4.2668 7.5313 5.58409 numMergedOcc 0
2 mol 66 unq 0 iso 0 dist 7.03034 5.25191 8.95789 6.66443 7.24524 4.73446 numMergedOcc 0
3 mol 66 unq 1 iso 0 dist 7.1612 6.03391 6.85819 5.85895 8.34154 5.36057 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 9.94012 15.1412 8.39046 14.5707 5.70318 5.97605 numMergedOcc 0
5 mol 86 unq 1 iso 0 dist 9.94012 9.27344 8.39947 14.5707 5.70318 9.09506 numMergedOcc 0
6 mol 86 unq 2 iso 0 dist 5.85076 8.96878 8.39046 9.60393 5.70318 5.97605 numMergedOcc 0
7 mol 86 unq 3 iso 0 dist 5.85076 7.68813 8.39947 9.60393 5.70318 9.09506 numMergedOcc 0
8 mol 86 unq 4 iso 0 dist 7.18799 8.79483 9.62655 8.38738 5.62388 5.7161 numMergedOcc 0
9 mol 86 unq 5 iso 0 dist 8.4254 8.47281 9.62655 5.711 5.62388 5.7161 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 4.90334 6.42715 7.00683 4.55923 8.64731 7.88524 numMergedOcc 0
11 mol 211 unq 0 iso 0 dist 5.02094 9.43858 9.8921 11.4093 9.37348 5.54302 numMergedOcc 0
12 mol 211 unq 1 iso 0 dist 5.02094 4.19883 8.50841 11.4093 9.37348 11.7472 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 5.12798 7.70847 9.81136 4.48711 8.6301 9.74975 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 5.12798 6.52672 7.25293 4.48711 8.6301 10.7332 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 7.6174 8.00807 7.20862 12.1708 5.78519 11.683 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 7.19924 15.6809 9.09835 4.53929 7.65349 14.8838 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 7.19924 12.3037 7.21466 4.53929 7.65349 10.5197 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 9.26382 12.2374 7.53352 13.6823 6.54612 12.1486 numMergedOcc 0
19 mol 254 unq 1 iso 0 dist 9.26382 8.99253 7.80793 13.6823 6.54612 11.2594 numMergedOcc 0
20 mol 254 unq 2 iso 0 dist 9.73281 14.9316 7.53352 13.7487 6.54612 12.1486 numMergedOcc 0
21 mol 254 unq 3 iso 0 dist 9.73281 13.1153 7.80793 13.7487 6.54612 11.2594 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 4.09984 9.64395 8.70702 8.40853 9.06874 11.8428 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 4.09984 9.64395 8.70702 6.77626 9.03326 9.94206 numMergedOcc 0
24 mol 285 unq 2 iso 0 dist 4.09984 10.5268 9.43706 8.40853 9.06874 5.18017 numMergedOcc 0
25 mol 285 unq 3 iso 0 dist 4.09984 10.5268 9.43706 6.77626 9.03326 9.65581 numMergedOcc 0
26 mol 285 unq 4 iso 0 dist 4.09984 6.59466 9.3482 8.40853 9.06874 14.5588 numMergedOcc 0
27 mol 285 unq 5 iso 0 dist 4.09984 6.59466 9.3482 6.77626 9.03326 12.0471 numMergedOcc 0
28 mol 293 unq 0 iso 0 dist 8.27274 11.8152 8.42712 7.94797 8.58317 5.15633 numMergedOcc 0
