0 mol 18 unq 0 iso 0 dist 8.5884 9.74802 15.9017 9.04157 4.96019 15.9136 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.29561 8.23162 9.27276 7.32472 7.65753 8.50202 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.29561 6.57908 10.0379 7.32472 7.65753 12.0023 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.83301 8.00967 6.79455 7.73997 10.1829 4.74211 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.82919 4.93077 9.60531 4.74574 9.25177 3.75088 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 4.4866 9.01453 4.83002 9.02073 6.95966 5.27645 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 6.31934 8.91572 6.03786 8.1717 7.31044 5.27573 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.09587 6.89859 8.78942 9.06957 12.7617 9.82878 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 8.80616 8.50045 6.14032 8.18193 4.5348 6.52215 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 8.80616 7.90329 5.47189 8.18193 4.5348 8.68818 numMergedOcc 0
10 mol 114 unq 2 iso 0 dist 8.80616 9.31512 16.9973 8.18193 4.5348 17.3211 numMergedOcc 0
11 mol 114 unq 3 iso 0 dist 8.25015 8.50045 16.6737 8.18193 15.571 6.52215 numMergedOcc 0
12 mol 114 unq 4 iso 0 dist 8.25015 7.90329 15.2678 8.18193 15.571 8.68818 numMergedOcc 0
13 mol 114 unq 5 iso 0 dist 8.25015 9.31512 5.01204 8.18193 15.571 17.3211 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.17723 5.44212 10.5028 7.39043 5.05766 9.1398 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 5.16772 8.76664 6.04407 7.13397 11.9315 14.7338 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 5.16772 8.76664 6.04407 5.33278 8.79837 8.77583 numMergedOcc 0
17 mol 260 unq 2 iso 0 dist 5.16772 9.00987 8.32254 7.13397 11.9315 11.4575 numMergedOcc 0
18 mol 260 unq 3 iso 0 dist 5.16772 9.00987 8.32254 5.33278 8.79837 13.8433 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 8.78501 8.93824 8.72736 7.51951 15.5294 11.6746 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 8.78501 6.1432 6.06397 7.51951 15.5294 11.7541 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 5.59641 8.93824 12.8542 7.51951 12.1427 11.6746 numMergedOcc 0
22 mol 266 unq 3 iso 0 dist 5.59641 6.1432 5.18289 7.51951 12.1427 11.7541 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 6.28768 9.41532 8.66166 7.58381 10.9892 7.5102 numMergedOcc 0
