0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 16.6461 9.67164 13.156 24.1509 14.6751 14.5008 9.96415 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.6104 8.41585 4.7739 5.99459 6.88805 11.3302 7.15287 6.22892 9.96415 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 5.73067 5.79134 7.50293 5.96514 7.26639 4.40004 7.96306 7.46414 8.80956 4.74069 numMergedOcc 0
3 mol 38 unq 1 iso 0 dist 5.73067 5.48241 9.91611 5.96514 7.26639 8.68364 7.96306 7.46414 12.4417 4.74069 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.20538 6.93876 8.66265 7.2452 9.03564 6.75591 14.8622 15.6547 14.6148 8.25594 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.72689 13.7794 9.36773 10.0429 7.80898 12.1193 19.6536 14.7449 15.7759 9.76849 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 7.74197 4.0486 9.36773 11.151 7.80898 12.1193 13.6693 14.7449 15.7759 9.76849 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 4.57067 6.04595 5.03039 10.1126 6.06198 12.411 8.86846 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.28278 14.5776 8.54584 9.05571 5.51197 12.1739 7.13958 4.80675 10.1938 8.85652 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 9.28278 14.5776 8.54584 9.63308 6.69691 8.26896 7.13958 4.80675 10.1938 9.31543 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.30654 11.3469 5.99315 9.60065 7.36975 13.1926 16.38 10.1013 12.8179 9.70788 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.84952 4.3158 7.81386 9.77747 9.01624 5.71898 16.849 12.5935 13.3844 8.39573 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 9.84952 12.9554 7.63312 9.77747 9.01624 5.93724 16.849 12.5935 9.63295 8.39573 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 6.96644 6.52816 9.49403 7.97183 4.25942 9.82156 6.75579 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 6.96644 6.52816 13.514 7.97183 4.25942 10.4618 6.75579 numMergedOcc 0
15 mol 205 unq 2 iso 0 dist 5.96555 5.87892 7.80463 6.96644 6.52816 3.56269 7.97183 4.25942 9.3629 6.75579 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.06771 6.64729 8.13497 9.0675 9.46361 12.2293 15.5491 11.0067 16.342 8.2518 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.06771 9.79538 7.88519 9.0675 9.46361 11.6988 15.5491 11.0067 13.6279 8.2518 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 9.54857 15.3806 7.46176 5.49348 5.85442 10.067 8.06908 6.18571 13.6279 8.40328 numMergedOcc 0
19 mol 259 unq 3 iso 0 dist 9.54857 15.3806 7.46176 5.13138 6.95511 11.6988 8.06908 6.18571 13.6279 8.2518 numMergedOcc 0
20 mol 259 unq 4 iso 0 dist 6.42725 8.70769 5.30224 6.09466 6.9899 7.09907 8.79685 12.3834 14.9752 8.40328 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 9.64596 5.26991 8.48753 3.7218 6.44147 5.12237 7.38085 4.78295 8.82094 5.38409 numMergedOcc 0
22 mol 272 unq 1 iso 0 dist 9.64596 5.26991 8.48753 3.7218 6.44147 5.12237 11.6897 8.26567 9.80332 8.45524 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 9.29635 10.8075 9.7748 12.2421 8.9682 17.6038 6.70414 5.77904 8.35794 9.91103 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 9.29635 10.8075 9.7748 10.9521 6.92711 14.772 6.70414 5.77904 8.35794 7.0603 numMergedOcc 0
