0 mol 5 unq 0 iso 0 dist 5.63583 6.46284 9.59917 7.62938 8.41594 5.31713 4.72414 9.12986 10.1441 12.0531 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 9.48375 9.40953 17.1356 8.16102 16.7495 3.21417 5.40134 8.57551 14.7077 13.0426 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 9.48375 9.57896 16.6725 8.16102 16.7495 4.96577 5.40134 8.57551 13.7273 13.0426 numMergedOcc 0
3 mol 27 unq 2 iso 0 dist 6.85127 9.40953 12.1419 8.16102 12.314 3.21417 5.40134 9.32506 14.7077 13.0426 numMergedOcc 0
4 mol 27 unq 3 iso 0 dist 6.85127 9.57896 12.5927 8.16102 12.314 4.96577 5.40134 9.32506 13.7273 13.0426 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.20839 6.22498 3.83791 7.07055 6.65401 3.78604 11.4738 9.15136 9.27264 12.9193 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 6.72591 9.8506 8.01366 7.91749 8.03052 13.5156 4.44134 8.21863 12.6835 10.3756 numMergedOcc 0
7 mol 150 unq 0 iso 0 dist 6.80192 9.91991 8.04136 7.96309 8.06512 13.6094 4.36797 8.16324 12.5602 10.4123 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 6.45502 6.22696 7.41724 4.80508 7.82494 5.09517 11.8974 9.07685 15.1915 12.5389 numMergedOcc 0
9 mol 158 unq 1 iso 0 dist 6.45502 6.22696 7.41724 4.88625 5.34159 6.2149 11.8974 9.07685 15.1915 9.56702 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 7.03216 8.45614 12.8965 8.43599 5.28013 12.3855 7.7168 9.96156 15.234 13.8235 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 9.0757 9.53656 13.9278 9.35481 16.095 14.4056 10.1333 5.67457 11.8543 18.7829 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 9.0757 9.53656 13.9278 9.11936 7.551 15.3702 10.1333 5.67457 11.8543 12.5597 numMergedOcc 0
13 mol 184 unq 2 iso 0 dist 9.0757 9.53656 13.9278 8.20517 4.75805 9.99712 10.1333 5.67457 11.8543 6.03495 numMergedOcc 0
14 mol 184 unq 3 iso 0 dist 9.0757 7.06562 11.2707 9.35481 16.095 5.54499 10.1333 5.67457 14.4426 18.7829 numMergedOcc 0
15 mol 184 unq 4 iso 0 dist 9.0757 7.06562 11.2707 9.11936 7.551 6.15375 10.1333 5.67457 14.4426 12.5597 numMergedOcc 0
16 mol 184 unq 5 iso 0 dist 9.0757 7.06562 11.2707 8.20517 4.75805 9.56022 10.1333 5.67457 14.4426 6.03495 numMergedOcc 0
17 mol 184 unq 6 iso 0 dist 7.51045 8.32647 14.7937 6.03505 4.75805 11.1533 5.33924 5.67457 12.8032 6.03495 numMergedOcc 0
18 mol 184 unq 7 iso 0 dist 7.51045 8.32647 14.7937 6.30144 11.6574 3.74437 5.33924 5.67457 12.8032 10.8523 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 9.66533 8.70011 10.0389 7.81831 6.49466 3.64285 12.523 9.08316 16.2661 13.68 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 5.62295 6.52085 7.38786 4.69611 8.4652 6.53775 5.78192 8.45942 10.1758 10.1895 numMergedOcc 0
21 mol 284 unq 1 iso 0 dist 5.62295 9.84174 11.9492 4.69611 8.4652 13.4014 5.78192 8.45942 5.83416 10.1895 numMergedOcc 0
