0 mol 62 unq 0 iso 0 dist 8.27156 7.751 6.9103 12.0244 8.62608 9.69044 8.32519 5.9487 9.19512 14.3608 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.9651 4.60844 9.8703 10.8777 14.224 7.39665 7.51631 10.9724 8.19932 10.6721 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.27307 5.29207 5.99857 6.92837 8.99811 6.9362 5.38363 8.67853 9.08745 10.8149 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 6.92837 5.29207 6.9362 8.27307 8.99811 5.99857 5.38363 10.8149 9.08745 8.67853 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 6.86713 12.4753 8.27883 13.3871 6.59884 7.7152 10.575 4.73066 4.3439 4.20834 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 7.85583 10.864 8.47988 12.6172 4.8896 9.02706 8.83567 4.69658 5.92828 6.35793 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 7.85583 9.95307 8.0427 12.6172 4.8896 9.39168 8.83567 4.69658 9.1247 6.35793 numMergedOcc 0
7 mol 112 unq 2 iso 0 dist 8.86938 9.50897 8.47988 12.679 4.8896 9.02706 6.79584 4.69658 5.92828 6.35793 numMergedOcc 0
8 mol 112 unq 3 iso 0 dist 8.86938 11.9673 8.0427 12.679 4.8896 9.39168 6.79584 4.69658 9.1247 6.35793 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.31276 6.67639 9.10524 7.30919 14.069 9.00918 9.21333 14.9489 6.76852 9.39407 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 5.50687 4.4987 5.35237 7.30919 6.90348 7.99477 9.21333 7.89899 4.94473 9.39407 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 8.94541 8.17498 9.00918 15.8408 14.069 9.10524 9.68601 9.39407 6.76852 14.9489 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 8.94541 10.9758 7.99477 13.6391 6.90348 5.35237 9.68601 9.39407 4.94473 7.89899 numMergedOcc 0
13 mol 134 unq 4 iso 0 dist 7.30919 6.67639 9.00918 8.31276 14.069 9.10524 9.21333 9.39407 6.76852 14.9489 numMergedOcc 0
14 mol 134 unq 5 iso 0 dist 7.30919 4.4987 7.99477 5.50687 6.90348 5.35237 9.21333 9.39407 4.94473 7.89899 numMergedOcc 0
15 mol 142 unq 0 iso 0 dist 8.86346 13.5413 7.81207 13.95 5.32922 6.14151 10.3674 4.05822 5.42679 4.7832 numMergedOcc 0
16 mol 142 unq 1 iso 0 dist 4.93681 9.85239 7.81207 9.86383 5.32922 6.14151 6.4119 4.05822 5.42679 4.7832 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.77347 8.69152 6.61112 15.2469 7.09479 8.90571 16.5666 12.2442 9.17458 9.14919 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 8.77347 8.69152 6.61112 15.2469 7.09479 8.90571 15.5063 11.7398 7.36794 9.11577 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 9.93754 5.30128 6.50998 11.4745 13.3965 8.1945 8.81424 9.72811 8.74463 14.2198 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 8.85887 12.6528 9.58916 13.3833 8.96144 5.90924 19.5257 16.639 8.55386 8.3189 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 8.85887 12.6528 9.58916 17.9702 14.3597 5.90058 19.5257 16.639 8.55386 3.35448 numMergedOcc 0
22 mol 264 unq 2 iso 0 dist 6.65233 6.04707 8.29262 10.3349 4.92077 9.19754 13.9709 11.5587 9.87744 10.1415 numMergedOcc 0
