0 mol 92 unq 0 iso 0 dist 5.22996 6.09495 6.49956 7.25403 7.0561 4.3481 10.869 6.86728 9.33898 7.06939 numMergedOcc 0
1 mol 92 unq 1 iso 0 dist 5.22996 6.09495 6.49956 7.25403 7.0561 4.3481 14.4679 12.163 9.64443 12.4681 numMergedOcc 0
2 mol 115 unq 0 iso 0 dist 8.99731 7.64822 5.72642 6.3642 8.4965 5.03039 7.44784 5.61704 7.30858 6.04595 numMergedOcc 0
3 mol 115 unq 1 iso 0 dist 8.99731 7.64822 5.72642 6.3642 8.4965 5.03039 12.7842 6.4497 5.83991 10.5599 numMergedOcc 0
4 mol 115 unq 2 iso 0 dist 8.99731 7.64822 5.72642 6.3642 8.4965 5.03039 9.56867 7.3094 7.88312 11.8378 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.84146 13.7656 7.77116 15.9454 9.6121 6.9194 10.2589 3.78311 8.73993 12.31 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 8.84146 13.7656 7.77116 17.7274 9.57341 9.68677 10.2589 3.78311 8.73993 7.64052 numMergedOcc 0
7 mol 126 unq 0 iso 0 dist 7.68174 13.9162 9.46588 5.11016 8.66815 10.7549 12.477 5.5703 6.06638 11.4624 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 4.85559 7.09664 8.33077 7.12852 6.5739 7.21225 9.05626 5.97111 8.70949 10.4778 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 6.87562 9.03539 8.33077 3.79867 6.5739 7.21225 12.173 5.97111 8.70949 10.4778 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.19078 7.17016 9.77552 9.3543 6.92726 12.4535 13.9298 9.35627 8.56324 14.437 numMergedOcc 0
11 mol 152 unq 1 iso 0 dist 9.19078 11.3742 8.28642 9.3543 6.92726 9.84297 13.1463 5.70788 5.87555 10.4285 numMergedOcc 0
12 mol 152 unq 2 iso 0 dist 9.19078 11.3742 8.28642 9.3543 6.92726 9.84297 13.9298 9.35627 6.70283 14.437 numMergedOcc 0
13 mol 152 unq 3 iso 0 dist 9.19078 11.3742 8.28642 9.3543 6.92726 9.84297 18.3042 11.2078 8.67331 15.2732 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 4.97005 9.14781 8.64409 10.2673 8.57801 12.6058 11.0743 9.97575 9.09754 17.9507 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 9.04499 5.68063 7.862 12.9462 7.97027 8.84507 7.27481 6.42798 6.00706 6.74196 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 9.04499 5.68063 7.862 11.0561 6.81955 8.67203 7.27481 6.42798 6.00706 11.4707 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 9.04499 5.68063 7.862 9.50604 4.9876 6.02502 7.27481 6.42798 6.00706 8.36842 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.33735 15.9389 8.38865 13.5696 5.28771 4.1511 17.255 11.0628 7.22101 9.91384 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 9.33735 15.9389 8.38865 13.5696 5.28771 4.1511 20.5429 12.9587 7.09863 10.3016 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 9.33735 10.8811 5.4694 13.5696 5.28771 4.69247 17.255 11.0628 8.65997 9.91384 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 9.3376 12.696 8.92743 11.8662 6.42694 11.0437 14.4018 11.6847 8.22528 16.8558 numMergedOcc 0
22 mol 229 unq 1 iso 0 dist 9.3376 12.696 8.92743 11.8662 6.42694 11.0437 15.825 9.62106 7.03423 14.0816 numMergedOcc 0
23 mol 229 unq 2 iso 0 dist 9.3376 12.696 8.92743 6.73326 7.63917 11.9989 14.4018 11.6847 8.22528 16.8118 numMergedOcc 0
24 mol 229 unq 3 iso 0 dist 9.3376 12.696 8.92743 6.73326 7.63917 11.9989 15.825 9.62106 7.03423 16.0361 numMergedOcc 0
25 mol 229 unq 4 iso 0 dist 9.3376 6.44004 5.77318 11.8662 6.42694 7.46815 9.87839 7.7339 9.87838 14.0538 numMergedOcc 0
26 mol 229 unq 5 iso 0 dist 9.3376 6.44004 5.77318 6.73326 7.63917 5.37687 9.87839 7.7339 9.87838 12.9844 numMergedOcc 0
