0 mol 26 unq 0 iso 0 dist 6.73259 10.1809 7.61055 5.23054 6.73167 10.267 9.27369 5.30297 7.3022 6.07276 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.60352 4.53839 7.61055 12.0047 6.73167 10.267 10.6535 5.30297 7.3022 6.07276 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 6.12212 11.6261 8.19733 8.45505 7.99016 5.94068 10.7242 5.14532 6.24515 8.20298 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 6.12212 11.6261 8.19733 8.17661 6.41793 6.96883 10.7242 5.14532 6.24515 6.13351 numMergedOcc 0
4 mol 39 unq 2 iso 0 dist 6.12212 5.48821 8.57165 8.45505 7.99016 13.5954 10.7242 5.14532 13.709 8.20298 numMergedOcc 0
5 mol 39 unq 3 iso 0 dist 6.12212 5.48821 8.57165 8.17661 6.41793 13.0639 10.7242 5.14532 13.709 6.13351 numMergedOcc 0
6 mol 41 unq 0 iso 0 dist 8.19484 5.14132 5.52067 9.90656 7.56029 9.95354 9.57818 4.85777 6.42834 6.21128 numMergedOcc 0
7 mol 41 unq 1 iso 0 dist 8.19484 5.14132 5.52067 9.90656 7.56029 9.95354 12.1743 4.02147 9.12422 9.57024 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 8.42713 12.5605 7.85041 3.91263 7.8435 12.1673 9.82649 15.8624 21.3303 9.19977 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 8.42713 12.5605 7.85041 3.91263 7.8435 12.1673 7.4518 14.7862 18.9091 7.28831 numMergedOcc 0
10 mol 93 unq 2 iso 0 dist 8.42713 12.5605 7.85041 3.91263 7.8435 12.1673 9.1687 9.42916 17.0156 9.71411 numMergedOcc 0
11 mol 93 unq 3 iso 0 dist 8.21032 10.878 7.85041 15.8131 7.8435 12.1673 23.1889 15.8624 21.3303 9.19977 numMergedOcc 0
12 mol 93 unq 4 iso 0 dist 8.21032 10.878 7.85041 15.8131 7.8435 12.1673 22.7533 14.7862 18.9091 7.28831 numMergedOcc 0
13 mol 93 unq 5 iso 0 dist 8.21032 10.878 7.85041 15.8131 7.8435 12.1673 14.5196 9.42916 17.0156 9.71411 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 9.2042 12.9483 7.53158 5.18463 9.82982 12.9875 5.60184 13.1849 18.263 8.71789 numMergedOcc 0
15 mol 154 unq 1 iso 0 dist 9.2042 12.9483 7.53158 5.18463 9.82982 12.9875 7.08477 11.4511 16.7999 5.2693 numMergedOcc 0
16 mol 154 unq 2 iso 0 dist 9.2042 9.90775 7.43407 5.18463 9.82982 11.8727 5.60184 13.1849 15.0065 8.71789 numMergedOcc 0
17 mol 154 unq 3 iso 0 dist 9.2042 9.90775 7.43407 5.18463 9.82982 11.8727 7.08477 11.4511 15.4742 5.2693 numMergedOcc 0
18 mol 158 unq 0 iso 0 dist 6.92225 5.49464 6.39981 9.02669 6.11331 9.88872 15.5957 10.8263 12.3466 9.97968 numMergedOcc 0
19 mol 159 unq 0 iso 0 dist 9.90625 8.34466 7.13269 6.30259 6.07821 4.27525 12.8147 7.97232 5.9032 9.35202 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 7.47107 11.5684 9.77862 12.1522 5.53324 8.31541 13.3459 5.92931 11.6497 4.19371 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 7.47107 11.5684 9.77862 5.18485 6.72182 6.72001 9.76361 7.50057 9.3402 9.00322 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 8.28454 8.59036 7.29542 12.7272 7.8744 6.24324 16.6413 8.98957 10.8228 6.94762 numMergedOcc 0
23 mol 225 unq 1 iso 0 dist 8.28454 8.59036 7.29542 12.7272 7.8744 6.24324 13.2144 6.59663 7.73748 7.7086 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 5.22349 7.31906 6.57207 10.7358 9.39658 9.43777 18.7077 17.2823 16.7719 8.09509 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 5.63154 7.73611 8.23056 9.11782 7.37478 10.8722 11.3989 5.89415 12.8413 8.98854 numMergedOcc 0
26 mol 279 unq 1 iso 0 dist 5.63154 7.73611 8.23056 9.11782 7.37478 10.8722 18.2826 15.1378 17.3994 9.42255 numMergedOcc 0
