0 mol 54 unq 0 iso 0 dist 7.34695 5.0478 5.01159 10.8539 4.54428 9.20373 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 8.06956 5.39827 12.2523 9.60458 16.7281 5.67362 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.60633 8.14607 10.8667 6.56112 7.83265 8.38855 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 7.47107 7.14572 7.8245 6.29002 13.0251 9.48373 numMergedOcc 0
4 mol 74 unq 1 iso 0 dist 7.47107 7.14572 7.8245 11.2415 12.6093 5.65212 numMergedOcc 0
5 mol 75 unq 0 iso 0 dist 9.37955 8.52499 5.04643 10.0187 13.6659 9.3727 numMergedOcc 0
6 mol 75 unq 1 iso 0 dist 9.16165 6.2449 5.04643 5.34991 13.6659 9.3727 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 9.99265 8.6317 14.6801 11.1148 20.4174 8.2793 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 5.77703 9.45931 13.1683 15.773 17.6973 7.38183 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 4.65525 6.97467 5.66705 13.9009 10.6777 8.32841 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 4.65525 6.97467 5.66705 11.549 9.64606 6.56065 numMergedOcc 0
11 mol 156 unq 2 iso 0 dist 6.32577 6.97467 5.80433 13.9009 9.69588 8.32841 numMergedOcc 0
12 mol 156 unq 3 iso 0 dist 6.32577 6.97467 5.80433 11.549 12.3457 6.56065 numMergedOcc 0
13 mol 203 unq 0 iso 0 dist 9.38519 6.89817 6.52977 10.347 15.2064 8.83947 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 8.01717 6.74767 4.63072 11.4028 14.2164 9.69753 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 8.01717 6.74767 4.63072 4.71151 9.60784 6.74625 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.13071 8.82948 7.26562 16.9403 13.2944 8.53802 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 8.19596 8.82948 11.1391 16.9403 18.8662 8.53802 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 9.13071 8.82948 7.26562 16.9403 13.2944 8.53802 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 8.19596 8.82948 11.1391 16.9403 18.8662 8.53802 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.13071 8.82948 7.26562 16.9403 13.2944 8.53802 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 8.19596 8.82948 11.1391 16.9403 18.8662 8.53802 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 8.67773 5.67671 7.37725 6.74502 14.4605 9.55425 numMergedOcc 0
