0 mol 56 unq 0 iso 0 dist 6.78356 14.6957 8.63486 11.5077 5.07125 6.15355 22.386 15.8558 9.2898 11.0852 numMergedOcc 0
1 mol 115 unq 0 iso 0 dist 8.99731 7.64822 5.72642 6.3642 8.4965 5.03039 14.5979 7.27912 7.69765 10.9431 numMergedOcc 0
2 mol 115 unq 1 iso 0 dist 8.99731 7.64822 5.72642 6.3642 8.4965 5.03039 14.1895 10.5109 9.42082 14.3113 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 4.85559 7.09664 8.33077 7.12852 6.5739 7.21225 9.67398 6.76477 6.93139 7.5573 numMergedOcc 0
4 mol 130 unq 1 iso 0 dist 6.87562 9.03539 8.33077 3.79867 6.5739 7.21225 10.5464 6.76477 6.93139 7.5573 numMergedOcc 0
5 mol 152 unq 0 iso 0 dist 9.19078 7.17016 9.77552 9.3543 6.92726 12.4535 9.40483 4.71678 6.59889 10.4667 numMergedOcc 0
6 mol 152 unq 1 iso 0 dist 9.19078 7.17016 9.77552 9.3543 6.92726 12.4535 12.3659 7.11377 8.9192 13.6351 numMergedOcc 0
7 mol 152 unq 2 iso 0 dist 9.19078 11.3742 8.28642 9.3543 6.92726 9.84297 9.40483 4.71678 6.70693 10.4667 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 4.97005 10.0248 7.24795 10.2673 8.57801 3.90244 9.76574 9.40383 8.73533 11.5162 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 5.46768 7.00308 6.60567 4.79025 6.34234 5.41635 13.1403 9.48862 7.41662 11.6534 numMergedOcc 0
10 mol 195 unq 1 iso 0 dist 5.46768 7.00308 6.60567 6.01032 7.87972 11.9954 13.1403 9.48862 7.41662 16.4813 numMergedOcc 0
11 mol 195 unq 2 iso 0 dist 5.46768 5.34788 7.62942 4.79025 6.34234 6.04871 11.9351 8.89297 9.03441 11.3524 numMergedOcc 0
12 mol 195 unq 3 iso 0 dist 5.46768 5.34788 7.62942 6.01032 7.87972 8.04534 11.9351 8.89297 9.03441 12.8025 numMergedOcc 0
13 mol 207 unq 0 iso 0 dist 7.21449 11.0577 7.96797 11.9587 8.78061 4.56899 11.2629 5.47626 5.12567 4.76113 numMergedOcc 0
14 mol 207 unq 1 iso 0 dist 7.21449 11.0577 7.96797 11.9587 8.78061 4.56899 13.049 7.64813 6.0563 9.29133 numMergedOcc 0
15 mol 207 unq 2 iso 0 dist 7.21449 11.0577 7.96797 11.9587 8.78061 4.56899 16.1656 11.9725 8.1244 12.1046 numMergedOcc 0
16 mol 207 unq 3 iso 0 dist 9.22778 15.6632 7.96797 16.8541 8.78061 4.56899 14.6198 5.47626 5.12567 4.76113 numMergedOcc 0
17 mol 207 unq 4 iso 0 dist 9.22778 15.6632 7.96797 16.8541 8.78061 4.56899 15.4025 7.64813 6.0563 9.29133 numMergedOcc 0
18 mol 207 unq 5 iso 0 dist 9.22778 15.6632 7.96797 16.8541 8.78061 4.56899 18.7318 11.9725 8.1244 12.1046 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 9.05206 8.99603 7.63018 4.86533 9.14831 11.3763 8.25288 6.75621 8.63693 11.1983 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 7.00547 5.93967 9.18895 8.94002 9.22269 4.81762 10.5761 6.47351 9.7982 10.0412 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 9.33735 15.9389 8.38865 13.5696 5.28771 4.1511 15.4793 7.3164 5.23634 6.09335 numMergedOcc 0
22 mol 227 unq 1 iso 0 dist 9.33735 10.8811 5.4694 13.5696 5.28771 4.69247 15.4793 7.3164 6.91318 6.09335 numMergedOcc 0
23 mol 229 unq 0 iso 0 dist 9.3376 12.696 8.92743 11.8662 6.42694 11.0437 9.10498 6.93188 7.27993 12.4584 numMergedOcc 0
24 mol 229 unq 1 iso 0 dist 9.3376 12.696 8.92743 6.73326 7.63917 11.9989 9.10498 6.93188 7.27993 11.5308 numMergedOcc 0
25 mol 229 unq 2 iso 0 dist 9.3376 6.44004 5.77318 11.8662 6.42694 7.46815 9.10498 6.93188 6.95201 12.4584 numMergedOcc 0
26 mol 229 unq 3 iso 0 dist 9.3376 6.44004 5.77318 6.73326 7.63917 5.37687 9.10498 6.93188 6.95201 11.5308 numMergedOcc 0
