0 mol 29 unq 0 iso 0 dist 9.99467 8.03211 9.78134 10.2037 8.02814 7.71617 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 7.94701 5.07389 5.63499 10.3688 12.6452 9.31516 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.82294 14.2658 7.11238 12.8981 5.88036 8.13162 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.98208 15.1815 7.47162 18.4312 9.65371 7.75341 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 5.55798 3.45432 7.318 8.71103 9.57704 8.0318 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.99759 8.52805 9.8896 17.1682 15.1642 9.71722 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 5.81553 3.82552 6.6536 11.3926 14.4523 9.58666 numMergedOcc 0
7 mol 157 unq 0 iso 0 dist 8.78412 12.5289 6.07906 18.4497 9.8171 9.35772 numMergedOcc 0
8 mol 170 unq 0 iso 0 dist 9.05865 10.2179 9.66676 18.5551 15.6007 8.95292 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 5.21088 3.81315 7.75405 7.252 8.77024 7.578 numMergedOcc 0
10 mol 192 unq 1 iso 0 dist 5.21088 3.81315 7.75405 10.957 10.2291 9.24926 numMergedOcc 0
11 mol 192 unq 2 iso 0 dist 8.25609 3.81315 7.49971 7.252 13.9721 7.578 numMergedOcc 0
12 mol 192 unq 3 iso 0 dist 8.25609 3.81315 7.49971 10.957 5.67211 9.24926 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 9.35664 6.61517 6.65077 9.0153 9.10689 5.08438 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.12934 7.79226 7.03532 10.884 5.31074 9.03056 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 4.87053 4.91709 7.99441 9.31125 10.4672 5.07975 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 4.87053 5.96186 6.71817 9.31125 10.4672 4.85015 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 4.87053 9.55743 8.41524 9.31125 10.4672 8.15345 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 9.75065 7.1875 6.84199 13.429 8.04601 7.95874 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 5.90728 5.14231 5.32876 7.90132 8.51629 9.4181 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 5.90728 5.14231 5.32876 8.8375 4.67572 5.05882 numMergedOcc 0
