0 mol 0 unq 0 iso 0 dist 9.83355 8.65478 18.0375 11.3895 7.48645 16.887 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.6643 9.89914 5.47056 7.35595 9.25649 7.84204 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 9.6867 8.91922 6.5312 10.8781 5.38074 11.0978 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 5.13138 8.91922 4.45307 10.8781 9.07545 11.0978 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 7.61351 6.42785 9.25982 8.55448 6.77538 12.345 numMergedOcc 0
5 mol 28 unq 3 iso 0 dist 9.6147 5.75809 9.25982 10.1348 6.77538 12.345 numMergedOcc 0
6 mol 74 unq 0 iso 0 dist 9.60205 9.96475 11.35 6.32526 4.79413 12.2741 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 4.86701 8.69371 4.26808 9.57451 7.92876 9.56723 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 9.95533 8.92048 7.88487 10.6903 5.1101 10.4624 numMergedOcc 0
9 mol 147 unq 1 iso 0 dist 9.95533 8.92048 7.88487 15.5982 7.01133 14.5864 numMergedOcc 0
10 mol 147 unq 2 iso 0 dist 7.94147 8.84926 8.40786 12.5048 5.1101 12.6781 numMergedOcc 0
11 mol 147 unq 3 iso 0 dist 7.94147 8.84926 8.40786 12.2623 7.01133 14.9237 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.03496 7.62945 9.42515 5.25258 9.59034 12.0223 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 7.46207 6.10013 5.43768 6.6036 8.76185 6.17074 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.35023 6.92906 5.85068 17.6675 9.51311 14.3217 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 8.35023 5.57978 12.3165 17.6675 9.51311 21.8047 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.30744 9.31843 3.87041 5.4536 6.39918 9.28024 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 9.67619 5.35362 8.48896 6.87868 9.80746 9.94661 numMergedOcc 0
18 mol 278 unq 1 iso 0 dist 9.67619 5.35362 8.48896 10.7269 9.48589 13.7721 numMergedOcc 0
19 mol 278 unq 2 iso 0 dist 9.67619 8.22364 4.35961 6.87868 9.80746 10.6403 numMergedOcc 0
20 mol 278 unq 3 iso 0 dist 9.67619 8.22364 4.35961 10.7269 9.48589 12.27 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 7.84195 5.16266 7.93548 9.55097 8.23056 11.2355 numMergedOcc 0
