0 mol 1 unq 0 iso 0 dist 6.41817 7.16224 6.2936 11.6758 7.46399 7.69087 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 5.80623 9.19908 7.96312 8.21453 7.18409 5.24778 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 5.80623 9.19908 7.96312 6.8422 6.21163 12.0951 numMergedOcc 0
3 mol 27 unq 2 iso 0 dist 5.80623 11.8741 7.67129 8.21453 7.18409 7.83976 numMergedOcc 0
4 mol 27 unq 3 iso 0 dist 5.80623 11.8741 7.67129 6.8422 6.21163 12.7455 numMergedOcc 0
5 mol 27 unq 4 iso 0 dist 7.24775 14.4555 7.96312 14.1996 7.18409 5.24778 numMergedOcc 0
6 mol 27 unq 5 iso 0 dist 7.24775 14.4555 7.96312 10.2292 6.21163 12.0951 numMergedOcc 0
7 mol 27 unq 6 iso 0 dist 7.24775 12.0486 7.67129 14.1996 7.18409 7.83976 numMergedOcc 0
8 mol 27 unq 7 iso 0 dist 7.24775 12.0486 7.67129 10.2292 6.21163 12.7455 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 9.42195 12.2032 7.65069 8.63955 9.50228 14.9082 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 8.79499 7.98273 6.56978 6.7387 9.1593 7.66248 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 6.87901 6.38018 9.6403 8.22734 9.5002 9.44733 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 7.85045 9.9965 8.03113 9.09348 6.63731 4.44169 numMergedOcc 0
13 mol 116 unq 1 iso 0 dist 7.85045 5.73517 9.2638 9.09348 6.63731 13.3535 numMergedOcc 0
14 mol 120 unq 0 iso 0 dist 8.41086 5.39993 8.64019 6.56678 9.37051 11.5499 numMergedOcc 0
15 mol 120 unq 1 iso 0 dist 7.41599 12.6549 8.64019 8.15855 9.37051 11.5499 numMergedOcc 0
16 mol 125 unq 0 iso 0 dist 7.95423 8.96903 9.85979 11.8492 9.2657 13.8016 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 7.06589 9.07394 9.29788 14.3975 9.6479 8.79627 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 7.06589 11.6981 9.50983 14.3975 9.6479 5.05272 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 8.70383 14.7046 9.29788 12.7693 9.6479 8.79627 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 8.70383 12.0836 9.50983 12.7693 9.6479 5.05272 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 9.36891 8.66108 8.61452 10.1637 8.79637 9.69939 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 9.36891 8.66108 8.61452 5.61514 8.88458 12.0301 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 7.37358 8.66108 7.66302 10.6703 8.16582 8.76427 numMergedOcc 0
