0 mol 4 unq 0 iso 0 dist 7.53929 8.60134 3.25279 9.82659 9.80438 8.68164 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.42607 5.59847 5.23547 13.2938 9.07476 9.89425 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 6.20956 5.59847 6.74026 13.2938 9.94905 9.89425 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 9.4649 8.44727 12.9864 4.86477 11.3419 9.46349 numMergedOcc 0
4 mol 18 unq 1 iso 0 dist 6.45965 8.44727 3.91445 4.86477 6.09533 9.46349 numMergedOcc 0
5 mol 20 unq 0 iso 0 dist 9.62492 8.98326 6.3965 9.00405 10.1439 4.36087 numMergedOcc 0
6 mol 20 unq 1 iso 0 dist 9.62492 8.98326 6.3965 7.86889 11.7373 7.09639 numMergedOcc 0
7 mol 20 unq 2 iso 0 dist 8.67226 8.98326 4.76485 9.00405 7.17695 4.36087 numMergedOcc 0
8 mol 20 unq 3 iso 0 dist 8.67226 8.98326 4.76485 7.86889 9.33207 7.09639 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 6.35249 6.94712 6.10822 5.15508 11.1422 9.41463 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 9.073 6.09085 6.4113 11.023 8.18214 5.64092 numMergedOcc 0
11 mol 68 unq 1 iso 0 dist 9.073 6.09085 6.4113 8.24064 14.5952 8.71074 numMergedOcc 0
12 mol 69 unq 0 iso 0 dist 9.34288 7.40698 4.69809 11.2122 5.75135 9.08745 numMergedOcc 0
13 mol 70 unq 0 iso 0 dist 9.2794 8.63204 11.0976 5.00416 13.523 7.99194 numMergedOcc 0
14 mol 70 unq 1 iso 0 dist 9.2794 5.4014 6.92915 5.00416 13.523 7.80313 numMergedOcc 0
15 mol 73 unq 0 iso 0 dist 9.60134 5.91019 10.0714 4.05022 11.8856 4.27766 numMergedOcc 0
16 mol 93 unq 0 iso 0 dist 4.45006 7.49235 3.91263 7.76629 5.10693 6.67678 numMergedOcc 0
17 mol 93 unq 1 iso 0 dist 4.45006 7.49235 3.91263 8.52218 6.58814 7.24956 numMergedOcc 0
18 mol 93 unq 2 iso 0 dist 4.45006 7.49235 3.91263 3.83191 6.13459 8.28591 numMergedOcc 0
19 mol 93 unq 3 iso 0 dist 4.45006 7.49235 3.91263 3.77555 7.54391 9.40687 numMergedOcc 0
20 mol 93 unq 4 iso 0 dist 4.45006 7.19431 5.59024 3.83191 6.13459 5.35008 numMergedOcc 0
21 mol 93 unq 5 iso 0 dist 4.45006 7.19431 5.59024 3.77555 7.54391 8.84576 numMergedOcc 0
22 mol 95 unq 0 iso 0 dist 9.35364 8.57607 17.1595 6.56529 15.4974 4.3439 numMergedOcc 0
23 mol 95 unq 1 iso 0 dist 9.35364 6.1991 15.0045 6.56529 15.4974 6.05855 numMergedOcc 0
24 mol 154 unq 0 iso 0 dist 9.71025 8.59532 7.4198 11.1637 14.5259 7.47401 numMergedOcc 0
25 mol 169 unq 0 iso 0 dist 8.11268 9.70796 14.9735 7.64279 7.33643 8.93091 numMergedOcc 0
26 mol 169 unq 1 iso 0 dist 9.19569 8.89822 7.0638 12.9917 9.58901 4.11374 numMergedOcc 0
27 mol 169 unq 2 iso 0 dist 9.19569 8.89822 7.0638 12.2955 12.3909 8.37602 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 9.51189 9.00537 12.4735 16.5552 21.5005 9.17458 numMergedOcc 0
29 mol 186 unq 1 iso 0 dist 9.51189 9.00537 12.4735 14.3824 19.7953 7.36794 numMergedOcc 0
30 mol 186 unq 2 iso 0 dist 6.22466 8.9388 3.6848 9.09753 6.99587 9.17458 numMergedOcc 0
31 mol 186 unq 3 iso 0 dist 6.22466 8.9388 3.6848 6.7472 4.37577 7.36794 numMergedOcc 0
32 mol 204 unq 0 iso 0 dist 9.19343 6.51936 3.72636 10.816 10.0199 7.33774 numMergedOcc 0
33 mol 204 unq 1 iso 0 dist 9.19343 6.51936 3.72636 4.27546 9.90861 6.39122 numMergedOcc 0
34 mol 205 unq 0 iso 0 dist 8.95136 6.32553 10.0544 3.30102 8.87165 4.97301 numMergedOcc 0
35 mol 233 unq 0 iso 0 dist 8.36772 6.0751 6.41724 5.31235 10.1933 8.4338 numMergedOcc 0
36 mol 233 unq 1 iso 0 dist 8.83541 6.0751 10.8172 5.31235 13.7284 8.4338 numMergedOcc 0
37 mol 233 unq 2 iso 0 dist 7.55878 6.0751 3.98113 5.31235 11.3962 8.4338 numMergedOcc 0
38 mol 239 unq 0 iso 0 dist 9.27632 6.95744 5.59638 3.68745 8.53092 7.97504 numMergedOcc 0
39 mol 260 unq 0 iso 0 dist 7.46 6.19564 6.73886 9.96926 9.46576 7.49606 numMergedOcc 0
40 mol 260 unq 1 iso 0 dist 6.71406 6.19564 5.38205 9.96926 11.9193 7.49606 numMergedOcc 0
41 mol 285 unq 0 iso 0 dist 5.77107 7.12723 8.02755 8.32005 10.1649 4.27826 numMergedOcc 0
42 mol 285 unq 1 iso 0 dist 5.77107 7.12723 8.02755 7.07384 11.3128 5.82074 numMergedOcc 0
