0 mol 14 unq 0 iso 0 dist 6.62231 8.64855 5.67022 11.3463 12.6581 8.84686 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 8.79578 6.72872 5.40129 7.72003 6.94712 7.16132 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.53862 5.9651 4.46345 4.60844 13.5943 9.8703 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 6.88001 5.9651 5.53078 4.60844 11.4476 9.8703 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.30739 8.27307 5.36659 5.29207 7.40698 5.99857 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 9.30739 6.92837 5.6966 5.29207 7.40698 6.9362 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 9.88351 7.98132 5.09341 6.41869 13.764 9.87329 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 7.45209 6.86713 4.16047 12.4753 8.57607 8.27883 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 7.45209 6.86713 4.16047 6.52247 6.1991 5.75428 numMergedOcc 0
9 mol 95 unq 2 iso 0 dist 7.45209 6.86713 4.16047 5.89506 5.96246 8.57395 numMergedOcc 0
10 mol 95 unq 3 iso 0 dist 7.45209 6.86713 4.16047 6.40728 10.1197 9.85409 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 8.33187 8.84656 5.21119 14.2595 14.4558 9.33924 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 8.33187 8.84656 5.21119 15.9796 10.9586 7.93372 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.89665 6.22964 8.89771 10.9033 9.26725 9.21377 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 9.32657 9.93754 15.9687 5.30128 9.54673 6.50998 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 9.32657 9.93754 15.9687 7.291 13.3306 9.09424 numMergedOcc 0
16 mol 225 unq 2 iso 0 dist 9.32657 9.93754 15.9687 15.2642 22.689 8.14831 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 7.2692 8.85887 7.50444 12.6528 15.9988 9.58916 numMergedOcc 0
