0 mol 19 unq 0 iso 0 dist 6.8824 7.84393 10.38 9.01721 14.2971 7.82074 14.9301 17.2239 10.3915 8.4674 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.8824 7.84393 10.38 9.01721 14.2971 7.82074 10.1953 14.4019 5.03957 4.54938 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.33492 8.18518 9.01721 14.1404 14.9301 8.4674 12.9091 14.1708 5.80928 4.51865 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.33492 8.18518 9.01721 6.57145 10.1953 4.54938 10.7917 15.6111 7.34551 7.20519 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 8.33492 8.18518 9.01721 6.57145 10.1953 4.54938 12.9091 14.1708 5.80928 6.864 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 8.33492 7.84393 6.01189 9.01721 8.18518 7.82074 14.9301 14.1404 10.3915 8.4674 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 8.33492 7.84393 6.01189 9.01721 8.18518 7.82074 10.1953 6.57145 5.03957 4.54938 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 8.58581 6.85331 6.88453 9.20254 13.0211 6.86014 10.4452 16.0093 10.0952 8.86116 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.36674 7.44784 6.06198 7.64822 12.411 7.30858 12.7842 16.7775 10.8507 5.83991 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 9.36674 7.44784 6.06198 7.64822 12.411 7.30858 9.56867 16.6569 11.5723 7.88312 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 9.36674 9.56867 16.6569 9.97256 18.3228 6.11741 12.7842 16.7775 8.02349 9.33865 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 9.36674 9.56867 16.6569 7.64822 12.411 7.88312 7.44784 6.06198 11.5723 7.30858 numMergedOcc 0
12 mol 115 unq 4 iso 0 dist 9.36674 9.56867 16.6569 7.64822 12.411 7.88312 12.7842 16.7775 8.02349 5.83991 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 7.4963 9.89098 11.9436 8.96845 15.7632 9.91388 13.5771 16.8088 6.69554 9.52634 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 7.4963 9.89098 11.9436 8.96845 15.7632 9.91388 12.2343 17.0756 6.761 7.24514 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.84695 5.67862 8.44345 9.52819 13.403 6.37586 10.738 11.4917 5.49782 8.94367 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 8.84695 5.67862 8.44345 9.52819 13.403 6.37586 7.97208 7.46245 5.00817 6.49416 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 8.84695 5.67862 8.44345 12.4156 18.124 9.71307 10.738 11.4917 5.49782 9.86662 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 8.84695 7.97208 7.46245 12.5576 13.9196 6.54501 11.8406 8.08748 5.79898 9.89303 numMergedOcc 0
19 mol 134 unq 4 iso 0 dist 8.84695 7.97208 7.46245 9.52819 13.403 6.49416 10.738 11.4917 8.80819 8.94367 numMergedOcc 0
20 mol 134 unq 5 iso 0 dist 8.84695 7.97208 7.46245 9.52819 13.403 6.49416 5.67862 8.44345 5.00817 6.37586 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 9.30469 6.73365 12.0877 5.73338 9.09725 5.6234 12.3723 16.8008 6.2715 9.0018 numMergedOcc 0
22 mol 175 unq 1 iso 0 dist 9.30469 6.73365 12.0877 5.73338 9.09725 5.6234 9.45659 9.79219 5.35493 6.57069 numMergedOcc 0
23 mol 175 unq 2 iso 0 dist 9.30469 6.73365 12.0877 12.753 15.2411 9.92231 12.3723 16.8008 6.2715 7.652 numMergedOcc 0
24 mol 175 unq 3 iso 0 dist 9.30469 9.45659 9.79219 5.73338 9.09725 6.57069 12.3723 16.8008 8.16421 9.0018 numMergedOcc 0
25 mol 175 unq 4 iso 0 dist 9.30469 9.45659 9.79219 5.73338 9.09725 6.57069 6.73365 12.0877 5.35493 5.6234 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 7.29651 7.45401 12.5982 6.8549 10.0005 7.54065 15.0174 13.6139 13.8792 9.70748 numMergedOcc 0
27 mol 186 unq 1 iso 0 dist 7.29651 7.45401 12.5982 6.8549 10.0005 7.54065 11.5381 17.1525 5.74635 8.87694 numMergedOcc 0
28 mol 224 unq 0 iso 0 dist 9.31156 4.79841 6.87755 11.4653 12.2287 8.95269 9.04374 9.28732 4.70378 6.57273 numMergedOcc 0
29 mol 224 unq 1 iso 0 dist 9.31156 4.79841 6.87755 11.4653 12.2287 8.95269 15.1903 11.9963 11.5372 5.78342 numMergedOcc 0
30 mol 280 unq 0 iso 0 dist 6.88553 9.26066 6.07005 12.5899 10.6192 6.53701 12.5331 7.38048 5.51836 6.0664 numMergedOcc 0
31 mol 282 unq 0 iso 0 dist 9.06244 6.84554 6.17747 9.67023 12.9555 8.76532 14.1723 11.5782 10.0156 8.04483 numMergedOcc 0
32 mol 282 unq 1 iso 0 dist 9.06244 6.84554 6.17747 9.67023 12.9555 8.76532 9.51581 7.94567 4.66602 6.33524 numMergedOcc 0
33 mol 282 unq 2 iso 0 dist 9.06244 9.51581 7.94567 9.67023 12.9555 6.33524 14.1723 11.5782 5.39891 8.04483 numMergedOcc 0
34 mol 282 unq 3 iso 0 dist 9.06244 9.51581 7.94567 9.67023 12.9555 6.33524 6.84554 6.17747 4.66602 8.76532 numMergedOcc 0
