0 mol 19 unq 0 iso 0 dist 7.84393 8.75332 6.49317 9.01721 7.82074 11.6624 14.9301 10.3915 11.8484 8.4674 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.84393 8.75332 6.49317 9.01721 7.82074 11.6624 10.1953 5.03957 10.3648 4.54938 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.18518 8.63204 5.18512 14.1404 8.4674 10.1882 12.9091 5.80928 9.47529 4.51865 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.18518 8.63204 5.18512 6.57145 4.54938 6.92532 10.7917 7.34551 12.3486 7.20519 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 8.18518 8.63204 5.18512 6.57145 4.54938 6.92532 12.9091 5.80928 9.47529 6.864 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.85331 4.61828 6.00575 9.20254 6.86014 6.60423 10.4452 10.0952 5.97304 8.86116 numMergedOcc 0
6 mol 60 unq 0 iso 0 dist 8.8058 8.4928 9.62257 12.5818 6.43294 10.0962 17.8366 10.6819 13.0114 6.65595 numMergedOcc 0
7 mol 60 unq 1 iso 0 dist 8.8058 8.4928 9.62257 12.5818 6.43294 10.0962 17.4408 11.3621 11.343 9.25011 numMergedOcc 0
8 mol 60 unq 2 iso 0 dist 8.8058 8.4928 9.62257 12.5818 6.43294 10.0962 12.1949 5.51199 9.79058 8.52121 numMergedOcc 0
9 mol 75 unq 0 iso 0 dist 7.16583 6.59253 5.36954 6.77761 7.79912 11.1537 11.6681 5.64643 10.9465 8.56639 numMergedOcc 0
10 mol 75 unq 1 iso 0 dist 7.16583 6.59253 5.36954 6.77761 7.79912 11.1537 13.9013 10.4899 15.1872 8.59017 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 9.22376 9.924 10.121 5.75796 7.47541 12.3486 9.8682 6.9948 7.91778 7.97049 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 9.22376 9.924 10.121 3.85308 7.66905 7.33422 11.7729 10.7229 6.82174 7.95579 numMergedOcc 0
13 mol 85 unq 2 iso 0 dist 9.22376 9.924 10.121 3.85308 7.66905 7.33422 9.8682 6.9948 7.91778 6.19965 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 9.57498 6.14415 9.52882 6.89762 6.45675 7.12017 10.0165 5.33144 12.6602 7.47343 numMergedOcc 0
15 mol 100 unq 1 iso 0 dist 9.57498 6.14415 9.52882 6.89762 6.45675 7.12017 15.6218 9.71151 14.8674 8.86688 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 7.44784 8.99731 5.61704 7.64822 7.30858 5.72642 12.7842 10.8507 6.4497 5.83991 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 7.44784 8.99731 5.61704 7.64822 7.30858 5.72642 9.56867 11.5723 7.3094 7.88312 numMergedOcc 0
18 mol 115 unq 2 iso 0 dist 9.56867 8.99731 7.3094 9.97256 6.11741 10.9734 12.7842 8.02349 6.4497 9.33865 numMergedOcc 0
19 mol 115 unq 3 iso 0 dist 9.56867 8.99731 7.3094 7.64822 7.88312 5.72642 7.44784 11.5723 5.61704 7.30858 numMergedOcc 0
20 mol 115 unq 4 iso 0 dist 9.56867 8.99731 7.3094 7.64822 7.88312 5.72642 12.7842 8.02349 6.4497 5.83991 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 7.80525 9.92698 10.4713 4.84708 7.32223 13.1441 7.71295 7.25988 6.89124 8.31064 numMergedOcc 0
22 mol 253 unq 1 iso 0 dist 7.71295 9.92698 6.89124 4.84708 8.31064 13.1441 7.80525 7.25988 10.4713 7.32223 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 7.6414 6.40153 8.57648 13.6041 8.45658 16.596 13.063 7.00201 14.2635 9.14619 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 4.78812 7.11691 8.7909 5.27123 8.33638 8.46061 6.62923 5.40809 4.86504 8.46116 numMergedOcc 0
25 mol 272 unq 1 iso 0 dist 6.62923 7.11691 4.86504 5.27123 8.46116 8.46061 4.78812 5.40809 8.7909 8.33638 numMergedOcc 0
