0 mol 1 unq 0 iso 0 dist 7.804 9.83016 13.2418 9.29949 9.17934 16.2755 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 6.66292 5.16484 6.86774 6.54476 4.07888 6.38154 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 9.88328 7.10504 7.06257 9.1694 12.1771 5.29487 numMergedOcc 0
3 mol 37 unq 1 iso 0 dist 9.88328 9.83906 7.32392 9.1694 12.1771 7.12965 numMergedOcc 0
4 mol 37 unq 2 iso 0 dist 9.88328 8.06034 6.15799 9.1694 12.1771 9.64434 numMergedOcc 0
5 mol 51 unq 0 iso 0 dist 8.88953 8.71029 9.10817 9.62591 8.3762 7.23303 numMergedOcc 0
6 mol 51 unq 1 iso 0 dist 8.88953 8.71029 9.10817 9.21142 4.50391 12.5007 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 7.80345 9.05543 6.95187 5.38734 5.01743 5.07389 numMergedOcc 0
8 mol 53 unq 1 iso 0 dist 7.80345 5.91997 6.71669 5.38734 5.01743 7.7687 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 9.36692 6.73849 9.61764 6.05967 4.57682 5.92795 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 9.36692 6.73849 9.61764 8.30892 8.67704 10.2656 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 9.58375 6.66532 9.25754 8.14262 14.2864 10.9165 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 6.57002 6.66532 5.28557 8.14262 6.08589 10.9165 numMergedOcc 0
13 mol 122 unq 0 iso 0 dist 8.91539 7.23036 8.66482 7.77481 5.69357 3.65582 numMergedOcc 0
14 mol 246 unq 0 iso 0 dist 5.39126 8.11392 6.38727 8.95788 9.18663 12.3526 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 8.72269 4.32705 5.91648 7.24645 4.97773 6.27469 numMergedOcc 0
16 mol 270 unq 1 iso 0 dist 8.72269 4.32705 5.91648 9.17799 5.4997 8.94358 numMergedOcc 0
17 mol 270 unq 2 iso 0 dist 8.72269 4.32705 5.91648 9.30051 9.51213 8.4597 numMergedOcc 0
18 mol 270 unq 3 iso 0 dist 8.31761 4.32705 5.73572 7.24645 11.0645 6.27469 numMergedOcc 0
19 mol 270 unq 4 iso 0 dist 8.31761 4.32705 5.73572 9.17799 11.3022 8.94358 numMergedOcc 0
20 mol 270 unq 5 iso 0 dist 8.31761 4.32705 5.73572 9.30051 4.5781 8.4597 numMergedOcc 0
