0 mol 26 unq 0 iso 0 dist 8.06656 6.83623 9.72597 4.25444 8.42581 9.51421 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.26105 5.54975 5.13138 9.85137 9.07545 10.8781 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 7.46327 12.1054 5.89661 4.55399 7.85041 11.2152 numMergedOcc 0
3 mol 111 unq 0 iso 0 dist 5.61533 9.73916 4.86701 9.19878 7.92876 9.57451 numMergedOcc 0
4 mol 147 unq 0 iso 0 dist 9.60646 7.08131 9.95533 12.0852 5.1101 10.6903 numMergedOcc 0
5 mol 147 unq 1 iso 0 dist 9.60646 7.08131 9.95533 14.0758 7.01133 15.5982 numMergedOcc 0
6 mol 147 unq 2 iso 0 dist 9.60646 6.7343 7.94147 12.0852 5.1101 12.5048 numMergedOcc 0
7 mol 147 unq 3 iso 0 dist 9.60646 6.7343 7.94147 14.0758 7.01133 12.2623 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 9.07256 15.8488 8.67619 12.2445 8.21476 5.51913 numMergedOcc 0
9 mol 163 unq 1 iso 0 dist 9.07256 15.8488 8.67619 5.48417 7.66897 11.5521 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 6.38764 5.11561 7.30969 12.5293 9.23047 10.0465 numMergedOcc 0
11 mol 220 unq 1 iso 0 dist 6.38764 5.11561 7.30969 8.37477 8.66548 5.68493 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 8.24118 12.3914 9.28463 4.40826 9.42618 15.9901 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 7.44607 14.5936 8.35023 4.77595 9.51311 17.6675 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 9.70241 4.62155 9.06496 10.4764 7.25677 9.69453 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 8.31175 7.45625 7.84195 5.06556 8.23056 9.55097 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 8.31175 13.8886 9.2174 5.06556 8.23056 9.91994 numMergedOcc 0
