0 mol 45 unq 0 iso 0 dist 9.73896 5.84852 6.43774 6.96797 5.24762 7.2846 6.5822 11.2563 8.81358 7.58835 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 7.09258 10.0936 9.78528 13.592 8.24309 9.96708 10.3867 9.84449 10.7394 8.8178 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 7.02792 11.4302 9.35224 10.3136 7.80879 9.60661 6.20162 6.56369 5.88134 6.65086 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 7.02792 6.20162 6.56369 9.16549 12.6515 7.47343 9.54828 11.8665 5.33144 6.45675 numMergedOcc 0
4 mol 100 unq 2 iso 0 dist 7.02792 6.20162 6.56369 9.16549 12.6515 7.47343 6.87433 13.6959 10.1407 8.86688 numMergedOcc 0
5 mol 100 unq 3 iso 0 dist 7.02792 6.20162 6.56369 10.3136 7.80879 6.65086 11.4302 9.35224 5.88134 9.60661 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 6.3982 5.29965 5.11551 11.6013 6.5838 7.11972 15.2626 11.4095 10.498 6.90986 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 9.45717 4.28997 6.82262 11.7225 5.61668 8.22656 9.61798 10.2995 6.65743 7.24514 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.31743 10.2414 9.89303 8.5778 5.79898 6.54501 13.5276 9.93925 5.00526 6.49416 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.5778 13.5276 6.49416 14.8658 8.80819 8.94367 19.8541 12.5075 6.81259 9.86662 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 8.5778 13.5276 6.49416 13.131 5.00817 6.37586 19.8541 12.5075 6.81259 9.71307 numMergedOcc 0
11 mol 142 unq 0 iso 0 dist 6.91573 12.444 9.2313 12.0967 5.50998 7.73169 7.18287 5.31024 5.32922 7.26382 numMergedOcc 0
12 mol 142 unq 1 iso 0 dist 6.91573 7.18287 5.31024 12.0967 5.50998 7.26382 12.444 9.2313 5.32922 7.73169 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 9.56095 6.64179 6.23493 10.1181 5.71071 7.46303 7.67938 10.2463 7.66392 6.43582 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.47189 5.48717 7.54065 10.1325 5.74635 8.87694 11.9142 10.7914 9.50685 9.09754 numMergedOcc 0
15 mol 229 unq 0 iso 0 dist 7.81415 5.6419 9.06952 9.68636 6.84129 7.03423 10.705 13.2905 5.57838 8.22528 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 8.58958 14.7629 6.56247 7.17987 5.88703 9.45496 13.5847 9.36357 7.82322 6.7625 numMergedOcc 0
17 mol 234 unq 1 iso 0 dist 8.58958 13.5847 9.36357 7.17987 5.88703 6.7625 14.7629 6.56247 7.82322 9.45496 numMergedOcc 0
18 mol 234 unq 2 iso 0 dist 9.70004 14.3229 6.56247 13.9487 5.88703 9.45496 17.5883 9.36357 7.82322 6.7625 numMergedOcc 0
19 mol 234 unq 3 iso 0 dist 9.70004 17.5883 9.36357 13.9487 5.88703 6.7625 14.3229 6.56247 7.82322 9.45496 numMergedOcc 0
20 mol 234 unq 4 iso 0 dist 7.17987 14.7629 9.45496 8.58958 5.88703 6.56247 16.0172 12.9605 6.29886 8.34494 numMergedOcc 0
21 mol 234 unq 5 iso 0 dist 7.17987 14.7629 9.45496 8.58958 5.88703 6.56247 13.5847 6.7625 7.82322 9.36357 numMergedOcc 0
22 mol 234 unq 6 iso 0 dist 7.17987 13.5847 6.7625 8.58958 5.88703 9.36357 16.0172 12.9605 12.1694 8.34494 numMergedOcc 0
23 mol 234 unq 7 iso 0 dist 7.17987 13.5847 6.7625 8.58958 5.88703 9.36357 14.7629 9.45496 7.82322 6.56247 numMergedOcc 0
24 mol 234 unq 8 iso 0 dist 9.5181 9.15708 9.36357 12.0771 7.82322 6.56247 4.94699 6.7625 5.88703 9.45496 numMergedOcc 0
25 mol 234 unq 9 iso 0 dist 9.5181 4.94699 6.7625 12.0771 7.82322 9.45496 9.15708 9.36357 5.88703 6.56247 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 6.67907 5.81354 8.04248 6.0087 7.43758 8.35971 11.2678 15.1853 14.2337 8.03456 numMergedOcc 0
27 mol 236 unq 1 iso 0 dist 6.67907 5.81354 8.04248 6.0087 7.43758 8.35971 12.338 13.5269 14.7998 6.84306 numMergedOcc 0
28 mol 236 unq 2 iso 0 dist 6.67907 5.81354 8.04248 6.0087 7.43758 8.35971 12.431 15.7308 10.7497 9.99038 numMergedOcc 0
29 mol 236 unq 3 iso 0 dist 6.67907 5.81354 8.04248 6.0087 7.43758 8.35971 8.71933 14.9122 12.0369 9.78037 numMergedOcc 0
30 mol 236 unq 4 iso 0 dist 6.0087 11.2678 8.03456 12.1533 7.28249 9.81562 12.338 6.84306 5.79505 7.68742 numMergedOcc 0
31 mol 236 unq 5 iso 0 dist 6.0087 11.2678 8.03456 12.1533 7.28249 9.81562 12.431 9.99038 9.90963 6.27581 numMergedOcc 0
32 mol 236 unq 6 iso 0 dist 6.0087 12.338 6.84306 12.1533 7.28249 7.68742 11.2678 8.03456 5.79505 9.81562 numMergedOcc 0
33 mol 236 unq 7 iso 0 dist 6.0087 12.338 6.84306 12.1533 7.28249 7.68742 12.431 9.99038 11.3368 6.27581 numMergedOcc 0
34 mol 236 unq 8 iso 0 dist 6.0087 12.431 9.99038 12.1533 7.28249 6.27581 11.2678 8.03456 9.90963 9.81562 numMergedOcc 0
35 mol 236 unq 9 iso 0 dist 6.0087 12.431 9.99038 12.1533 7.28249 6.27581 12.338 6.84306 11.3368 7.68742 numMergedOcc 0
36 mol 253 unq 0 iso 0 dist 5.27188 5.34337 7.32223 10.4338 7.25988 8.31064 11.9048 11.6434 8.02948 6.73034 numMergedOcc 0
37 mol 259 unq 0 iso 0 dist 8.70852 5.07898 7.84554 11.1914 4.86771 7.88519 9.13047 9.95973 4.69778 8.13497 numMergedOcc 0
38 mol 259 unq 1 iso 0 dist 9.89728 5.07898 7.46176 11.1914 6.96053 7.88519 9.13047 10.3935 4.69778 8.13497 numMergedOcc 0
39 mol 259 unq 2 iso 0 dist 6.42437 5.07898 9.18903 11.1914 10.4881 7.88519 9.13047 12.6839 4.69778 8.13497 numMergedOcc 0
