0 mol 9 unq 0 iso 0 dist 8.77074 17.4675 9.27637 11.1449 4.74921 9.75403 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 13.2653 4.93188 10.3497 9.65174 13.5399 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.70141 5.80023 9.24958 10.3497 9.65174 15.0923 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.46609 13.1626 8.44506 9.54853 9.41425 6.33493 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 9.00593 9.68942 7.28416 13.3238 8.75468 4.55829 numMergedOcc 0
5 mol 28 unq 1 iso 0 dist 9.00593 9.68942 7.28416 10.4507 7.62989 5.13816 numMergedOcc 0
6 mol 28 unq 2 iso 0 dist 9.00593 9.68942 7.28416 3.45063 5.70238 7.07342 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 6.53468 14.2026 8.03303 12.7709 8.59337 6.28792 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 6.53468 14.2026 8.03303 13.1304 7.66942 4.4893 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 5.90954 9.27925 8.03303 7.78675 8.59337 6.28792 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 5.90954 9.27925 8.03303 7.76917 7.66942 4.4893 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 8.42713 17.674 9.81831 14.4533 6.46217 8.13232 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 8.42713 15.232 9.12858 14.4533 6.46217 9.79899 numMergedOcc 0
13 mol 93 unq 2 iso 0 dist 8.42713 12.5871 9.4523 14.4533 6.46217 13.6379 numMergedOcc 0
14 mol 93 unq 3 iso 0 dist 8.21032 6.25741 9.81831 3.24551 6.46217 8.13232 numMergedOcc 0
15 mol 93 unq 4 iso 0 dist 8.21032 10.0172 9.12858 3.24551 6.46217 9.79899 numMergedOcc 0
16 mol 93 unq 5 iso 0 dist 8.21032 13.6269 9.4523 3.24551 6.46217 13.6379 numMergedOcc 0
17 mol 114 unq 0 iso 0 dist 5.82501 7.6321 9.7918 5.40104 6.4569 4.97363 numMergedOcc 0
18 mol 147 unq 0 iso 0 dist 6.4752 8.95179 5.49226 11.3398 7.19893 4.19634 numMergedOcc 0
19 mol 147 unq 1 iso 0 dist 6.4752 8.95179 5.49226 6.78721 6.37938 4.45407 numMergedOcc 0
20 mol 147 unq 2 iso 0 dist 6.4752 10.5583 6.28351 11.3398 7.19893 10.2041 numMergedOcc 0
21 mol 147 unq 3 iso 0 dist 6.4752 10.5583 6.28351 6.78721 6.37938 10.5141 numMergedOcc 0
22 mol 158 unq 0 iso 0 dist 6.92225 9.86605 7.88319 10.5886 8.06621 6.60451 numMergedOcc 0
23 mol 162 unq 0 iso 0 dist 8.48559 6.46702 6.20182 10.5749 9.56342 4.51281 numMergedOcc 0
24 mol 163 unq 0 iso 0 dist 5.80513 4.12904 8.38738 5.5479 9.40912 4.2768 numMergedOcc 0
25 mol 175 unq 0 iso 0 dist 9.08628 4.358 8.0154 16.2286 7.6741 13.8965 numMergedOcc 0
26 mol 175 unq 1 iso 0 dist 8.35581 9.63193 8.0154 10.3387 7.6741 13.8965 numMergedOcc 0
27 mol 175 unq 2 iso 0 dist 6.72569 8.97821 8.0154 7.28678 7.6741 13.8965 numMergedOcc 0
28 mol 175 unq 3 iso 0 dist 9.12296 4.27736 7.35824 9.43753 6.90373 10.7092 numMergedOcc 0
29 mol 218 unq 0 iso 0 dist 9.6309 9.24732 8.86175 8.71194 6.62738 9.9009 numMergedOcc 0
30 mol 218 unq 1 iso 0 dist 9.6309 9.24732 8.86175 5.07361 7.13254 11.0018 numMergedOcc 0
31 mol 218 unq 2 iso 0 dist 9.6309 10.8948 6.29511 8.71194 6.62738 10.3884 numMergedOcc 0
32 mol 218 unq 3 iso 0 dist 9.6309 10.8948 6.29511 5.07361 7.13254 11.2389 numMergedOcc 0
33 mol 218 unq 4 iso 0 dist 9.86462 4.29962 8.0751 7.57188 5.4621 6.24608 numMergedOcc 0
34 mol 218 unq 5 iso 0 dist 9.86462 4.29962 8.0751 11.3371 8.91819 12.235 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 9.81593 8.32163 8.47784 18.713 9.76731 17.5547 numMergedOcc 0
36 mol 252 unq 1 iso 0 dist 9.81593 8.32163 8.47784 15.0079 8.38599 14.3189 numMergedOcc 0
37 mol 252 unq 2 iso 0 dist 9.81593 10.6815 8.66469 18.713 9.76731 11.5735 numMergedOcc 0
38 mol 252 unq 3 iso 0 dist 9.81593 10.6815 8.66469 15.0079 8.38599 6.19934 numMergedOcc 0
39 mol 252 unq 4 iso 0 dist 9.78248 16.5062 8.47784 3.91004 9.76731 17.5547 numMergedOcc 0
40 mol 252 unq 5 iso 0 dist 9.78248 16.5062 8.47784 3.76825 8.38599 14.3189 numMergedOcc 0
41 mol 252 unq 6 iso 0 dist 9.78248 9.67333 8.66469 3.91004 9.76731 11.5735 numMergedOcc 0
42 mol 252 unq 7 iso 0 dist 9.78248 9.67333 8.66469 3.76825 8.38599 6.19934 numMergedOcc 0
43 mol 264 unq 0 iso 0 dist 8.28871 11.5671 6.04162 9.86659 8.78525 5.82362 numMergedOcc 0
44 mol 264 unq 1 iso 0 dist 8.28871 13.8765 6.14323 9.86659 8.78525 10.6043 numMergedOcc 0
45 mol 264 unq 2 iso 0 dist 7.94668 5.21164 6.04162 9.26671 8.78525 5.82362 numMergedOcc 0
46 mol 264 unq 3 iso 0 dist 7.94668 6.12009 6.14323 9.26671 8.78525 10.6043 numMergedOcc 0
47 mol 277 unq 0 iso 0 dist 5.70326 9.08161 9.3936 4.20802 4.61089 10.724 numMergedOcc 0
