0 mol 13 unq 0 iso 0 dist 6.02651 9.65051 10.4833 6.42789 8.63643 13.8843 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 8.24422 9.86409 5.81701 6.51818 9.4148 13.1714 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 8.99724 9.86409 8.89091 6.51818 6.87842 13.1714 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 8.18794 8.94022 5.88946 8.34136 7.6477 11.7486 numMergedOcc 0
4 mol 32 unq 0 iso 0 dist 9.46895 6.19304 12.7517 11.4081 8.22628 14.6638 numMergedOcc 0
5 mol 32 unq 1 iso 0 dist 9.46895 6.19304 12.7517 4.56364 9.82819 9.72274 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 8.76925 9.70029 6.8989 9.04728 8.61287 9.15135 numMergedOcc 0
7 mol 39 unq 1 iso 0 dist 8.76925 9.70029 6.8989 11.4523 7.92518 6.13351 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 7.67459 8.74005 8.59948 9.50501 6.57633 14.5575 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 5.48997 8.87151 9.58376 11.1122 7.50377 12.7627 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 5.37449 7.3795 7.75939 7.15288 9.73179 7.46095 numMergedOcc 0
11 mol 96 unq 0 iso 0 dist 7.64192 9.44292 8.80734 4.475 9.62431 11.9494 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.5614 7.38183 9.5453 9.88447 7.95751 12.3695 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.5614 7.38183 9.5453 8.09962 5.39002 11.4776 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 8.95432 8.57657 7.35951 11.7299 7.68074 14.5039 numMergedOcc 0
15 mol 158 unq 1 iso 0 dist 8.95432 8.57657 7.35951 17.16 9.1854 15.4509 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 7.6409 8.09667 4.93748 9.55695 6.84679 11.554 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 8.94889 8.78652 4.36112 10.3044 7.80421 10.4725 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 8.94889 8.78652 4.36112 4.3844 9.71107 11.1817 numMergedOcc 0
19 mol 210 unq 2 iso 0 dist 8.94889 8.78652 4.36112 6.85132 9.7449 11.4429 numMergedOcc 0
20 mol 210 unq 3 iso 0 dist 8.94889 9.01437 10.7545 10.3044 7.80421 12.9836 numMergedOcc 0
21 mol 210 unq 4 iso 0 dist 8.94889 9.01437 10.7545 4.3844 9.71107 13.2178 numMergedOcc 0
22 mol 210 unq 5 iso 0 dist 8.94889 9.01437 10.7545 6.85132 9.7449 14.8978 numMergedOcc 0
23 mol 244 unq 0 iso 0 dist 6.2667 5.60146 4.89551 4.69103 8.93589 6.53416 numMergedOcc 0
24 mol 281 unq 0 iso 0 dist 7.76659 9.81562 5.07985 6.33695 8.40612 12.6762 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 9.60309 8.18174 5.09064 4.30667 7.38515 7.83214 numMergedOcc 0
