0 mol 11 unq 0 iso 0 dist 9.53002 4.30695 11.9464 8.01262 16.7805 6.03873 7.27724 13.9627 7.56871 5.67087 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.53002 4.30695 11.9464 6.58046 3.56133 8.84131 7.27724 13.9627 7.56871 10.4826 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 9.53002 6.35398 7.5901 8.01262 16.7805 12.9584 7.85924 5.43238 9.09091 15.2717 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 9.53002 6.35398 7.5901 6.58046 3.56133 6.51674 7.85924 5.43238 9.09091 5.25331 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.58657 6.41423 5.90856 7.7312 9.61438 5.31883 4.69858 10.7418 5.82366 6.38574 numMergedOcc 0
5 mol 32 unq 0 iso 0 dist 8.68559 7.99969 7.14527 8.91596 4.84198 10.8132 6.68431 7.48825 4.62858 10.9253 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 9.4278 13.4402 4.97525 6.75888 8.80108 8.71468 13.2217 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.96555 5.37007 6.85455 4.17838 4.07336 3.77771 9.97281 13.3416 7.1539 10.4834 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 8.71128 6.84011 9.23527 9.93438 5.80637 5.99273 5.31367 11.976 8.809 12.6545 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 8.71128 6.84011 9.23527 9.93438 5.80637 5.99273 8.88748 10.1737 5.79343 7.93956 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 6.91348 8.70296 9.93183 8.80895 6.25029 5.92118 7.90484 13.8783 9.2235 13.4143 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 9.51418 8.70296 16.5048 8.80895 13.4297 5.92118 7.90484 16.6297 9.2235 13.4143 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 7.98142 5.94469 8.93991 8.29467 9.55459 3.63671 6.7991 12.2455 7.05653 6.91878 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 7.37327 5.94469 5.35588 8.29467 7.66761 3.63671 6.7991 11.691 7.05653 6.91878 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 9.58736 9.55668 13.128 8.08965 14.2299 6.82702 4.65302 11.9287 7.95766 9.11149 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 8.94231 3.94343 13.4894 10.8635 11.5207 7.04753 11.209 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 8.14172 7.02333 4.38002 8.88652 12.0336 13.4894 5.68826 6.00721 7.04753 11.209 numMergedOcc 0
17 mol 238 unq 2 iso 0 dist 8.09066 7.02333 11.5793 8.88652 3.94343 13.4894 5.68826 11.5207 7.04753 11.209 numMergedOcc 0
18 mol 238 unq 3 iso 0 dist 6.77463 8.67864 4.38002 6.46771 12.0336 13.4894 4.87097 6.00721 7.04753 11.209 numMergedOcc 0
19 mol 238 unq 4 iso 0 dist 7.2766 8.67864 11.5793 6.46771 3.94343 13.4894 4.87097 11.5207 7.04753 11.209 numMergedOcc 0
