0 mol 24 unq 0 iso 0 dist 8.3964 9.85198 8.60554 13.3476 6.99746 6.72502 18.1292 14.1496 8.44664 7.6844 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.3964 9.85198 8.60554 13.3476 6.99746 6.72502 15.1953 9.62033 9.44691 7.05541 numMergedOcc 0
2 mol 65 unq 0 iso 0 dist 8.54555 10.2068 6.72639 16.1661 9.35965 9.14931 7.0386 5.56801 9.34791 10.7772 numMergedOcc 0
3 mol 65 unq 1 iso 0 dist 8.54555 5.38234 6.76508 5.12044 7.18126 8.37515 7.0386 5.56801 8.22785 6.00418 numMergedOcc 0
4 mol 65 unq 2 iso 0 dist 7.0386 10.2068 9.34791 16.1661 10.7772 9.14931 8.54555 5.56801 6.72639 9.35965 numMergedOcc 0
5 mol 65 unq 3 iso 0 dist 7.0386 5.38234 8.22785 5.12044 6.00418 8.37515 8.54555 5.56801 6.76508 7.18126 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.96747 6.09495 8.91313 11.0243 14.4996 6.61823 10.6424 11.5449 8.16392 6.90324 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 8.96747 6.09495 8.91313 5.22996 12.0757 6.49956 10.6424 11.5449 8.16392 7.64508 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 7.32407 5.99695 9.36851 10.5849 6.84211 8.03372 6.48695 5.41583 4.97175 4.53459 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 6.48695 5.99695 4.97175 10.5849 4.53459 8.03372 7.32407 5.41583 9.36851 6.84211 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 6.86997 9.70656 9.91993 11.1382 7.23332 9.74542 7.46919 4.32771 6.22055 7.89336 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 7.46919 9.70656 6.22055 11.1382 7.89336 9.74542 6.86997 4.32771 9.91993 7.23332 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 6.79381 9.69704 9.96691 11.1473 7.35366 9.6606 7.36989 4.39943 6.14675 7.86976 numMergedOcc 0
13 mol 150 unq 1 iso 0 dist 6.79381 9.69704 9.96691 11.1473 7.35366 9.6606 8.17805 5.93611 9.24244 11.8012 numMergedOcc 0
14 mol 150 unq 2 iso 0 dist 7.36989 9.69704 6.14675 11.1473 7.86976 9.6606 6.79381 4.39943 9.96691 7.35366 numMergedOcc 0
15 mol 150 unq 3 iso 0 dist 7.36989 9.69704 6.14675 11.1473 7.86976 9.6606 8.17805 4.30207 9.24244 11.8012 numMergedOcc 0
16 mol 150 unq 4 iso 0 dist 8.17805 9.69704 9.24244 11.1473 11.8012 9.6606 6.79381 5.93611 9.96691 7.35366 numMergedOcc 0
17 mol 150 unq 5 iso 0 dist 8.17805 9.69704 9.24244 11.1473 11.8012 9.6606 7.36989 4.30207 6.14675 7.86976 numMergedOcc 0
18 mol 171 unq 0 iso 0 dist 6.4751 9.28655 5.93786 11.1543 6.29877 7.71426 5.75085 3.98338 8.1344 5.90358 numMergedOcc 0
19 mol 171 unq 1 iso 0 dist 6.4751 10.4021 8.24693 11.1543 6.29877 5.10618 5.75085 3.98338 6.71356 5.90358 numMergedOcc 0
20 mol 171 unq 2 iso 0 dist 5.75085 9.28655 8.1344 11.1543 5.90358 7.71426 6.4751 3.98338 5.93786 6.29877 numMergedOcc 0
21 mol 171 unq 3 iso 0 dist 5.75085 10.4021 6.71356 11.1543 5.90358 5.10618 6.4751 3.98338 8.24693 6.29877 numMergedOcc 0
22 mol 188 unq 0 iso 0 dist 6.20426 9.41911 8.10214 10.2746 5.87427 8.57261 13.2745 9.01338 7.14503 5.0782 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 8.09776 10.977 6.72379 8.63008 7.50057 8.83356 14.7117 6.7294 8.29382 12.361 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 6.57575 11.4562 6.72379 12.3731 7.50057 8.83356 11.3191 6.7294 8.29382 12.361 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 9.30761 5.55582 6.72379 12.8922 7.50057 8.83356 11.2528 6.7294 8.29382 12.361 numMergedOcc 0
26 mol 195 unq 0 iso 0 dist 9.25935 7.00308 7.36683 5.46768 6.0634 6.60567 10.146 9.90317 6.95086 6.74112 numMergedOcc 0
