0 mol 26 unq 0 iso 0 dist 6.88695 6.66387 9.16962 14.5062 13.2136 8.82012 11.1296 15.962 7.84204 12.8511 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.2377 12.6436 5.64598 14.7651 7.4697 8.70133 10.0651 3.85805 7.78587 4.73407 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.2377 12.6436 5.64598 12.864 5.7113 4.65521 10.0651 3.85805 7.78587 5.17781 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 6.18305 4.31731 4.65521 11.0671 5.4148 8.70133 10.869 5.17781 7.78587 4.73407 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 6.18305 4.31731 4.65521 9.43662 5.7113 5.64598 10.869 5.17781 7.78587 3.85805 numMergedOcc 0
5 mol 75 unq 0 iso 0 dist 6.95595 8.91765 5.15851 14.747 9.02771 6.33365 11.2061 4.74027 7.30467 7.30118 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.44078 9.76996 8.39016 14.6132 7.60026 6.99355 10.177 4.79453 6.18681 6.34112 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 9.44078 9.76996 8.39016 14.6132 7.60026 6.99355 15.1616 7.5298 9.33288 4.87139 numMergedOcc 0
8 mol 90 unq 2 iso 0 dist 5.9179 4.97513 8.39016 9.34782 7.60026 6.99355 6.10053 4.79453 6.18681 6.34112 numMergedOcc 0
9 mol 90 unq 3 iso 0 dist 5.9179 4.97513 8.39016 9.34782 7.60026 6.99355 10.6805 7.5298 9.33288 4.87139 numMergedOcc 0
10 mol 90 unq 4 iso 0 dist 9.34782 4.97513 6.99355 5.9179 7.60026 8.39016 6.10053 6.34112 6.18681 4.79453 numMergedOcc 0
11 mol 90 unq 5 iso 0 dist 9.34782 4.97513 6.99355 5.9179 7.60026 8.39016 10.6805 4.87139 9.33288 7.5298 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 9.44713 9.39191 8.68821 14.3625 8.66412 7.12609 13.9615 10.5728 9.26486 5.74761 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 8.5119 11.711 7.17547 13.3259 7.83217 7.13323 20.2276 14.5747 8.5244 11.7256 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 7.70279 6.17401 7.07392 12.1893 4.96364 9.62952 9.67243 4.14873 8.49913 6.71567 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 7.86368 15.442 7.85175 12.3151 5.88703 6.25105 19.2408 12.7879 7.91374 13.8525 numMergedOcc 0
16 mol 256 unq 0 iso 0 dist 7.67598 9.40096 5.24676 16.8309 9.92128 8.09363 13.3942 6.73995 5.85613 4.6374 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 12.7634 9.53031 9.28024 6.65799 numMergedOcc 0
