0 mol 7 unq 0 iso 0 dist 9.36807 6.1206 7.92429 7.67927 11.2233 4.80709 13.8829 9.97624 11.2901 16.0449 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 9.36807 7.67927 11.2233 6.1206 7.92429 4.80709 13.8829 9.97624 16.0449 11.2901 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.47421 8.55451 5.66192 5.8245 3.91075 3.58336 9.5997 9.57198 14.126 10.9352 numMergedOcc 0
3 mol 9 unq 0 iso 1 dist 8.47421 5.8245 3.91075 8.55451 5.66192 3.58336 9.5997 9.57198 10.9352 14.126 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.89374 8.96727 14.6599 8.01308 9.47022 6.20884 5.49591 9.11258 9.01564 7.11065 numMergedOcc 0
5 mol 58 unq 0 iso 1 dist 8.89374 8.01308 9.47022 8.96727 14.6599 6.20884 5.49591 9.11258 7.11065 9.01564 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 4.65521 8.68662 6.10063 7.4369 6.15714 3.30399 6.56633 7.10439 8.96616 6.14542 numMergedOcc 0
7 mol 73 unq 0 iso 1 dist 4.65521 7.4369 6.15714 8.68662 6.10063 3.30399 6.56633 7.10439 6.14542 8.96616 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 8.72704 7.82475 12.5061 5.35782 12.1093 3.5565 10.6245 6.0652 14.2784 13.2583 numMergedOcc 0
9 mol 100 unq 0 iso 1 dist 8.72704 5.35782 12.1093 7.82475 12.5061 3.5565 10.6245 6.0652 13.2583 14.2784 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 5.42582 9.33924 6.0991 7.93372 5.67107 11.4107 5.29786 8.73604 12.2587 9.0176 numMergedOcc 0
11 mol 134 unq 0 iso 1 dist 5.42582 7.93372 5.67107 9.33924 6.0991 11.4107 5.29786 8.73604 9.0176 12.2587 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 8.94837 9.00918 5.58312 7.99477 9.61537 4.87973 14.2198 6.93279 7.83568 12.0743 numMergedOcc 0
13 mol 134 unq 1 iso 1 dist 8.94837 7.99477 9.61537 9.00918 5.58312 4.87973 14.2198 6.93279 12.0743 7.83568 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 7.98142 6.64173 4.48306 9.01624 12.2513 11.196 5.63555 5.97685 8.12266 10.5303 numMergedOcc 0
15 mol 181 unq 0 iso 1 dist 7.98142 9.01624 12.2513 6.64173 4.48306 11.196 5.63555 5.97685 10.5303 8.12266 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 7.98142 6.64173 4.48306 9.55105 10.2172 10.1041 5.63555 5.97685 8.12266 9.43306 numMergedOcc 0
17 mol 181 unq 1 iso 1 dist 7.98142 9.55105 10.2172 6.64173 4.48306 10.1041 5.63555 5.97685 9.43306 8.12266 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 7.98142 9.01624 12.2513 9.55105 10.2172 3.55187 5.63555 5.97685 10.5303 9.43306 numMergedOcc 0
19 mol 181 unq 1 iso 1 dist 7.98142 9.55105 10.2172 9.01624 12.2513 3.55187 5.63555 5.97685 9.43306 10.5303 numMergedOcc 0
20 mol 181 unq 2 iso 0 dist 7.37327 6.64173 4.88823 9.01624 14.8923 11.196 5.63555 8.9289 8.12266 10.5303 numMergedOcc 0
21 mol 181 unq 2 iso 1 dist 7.37327 9.01624 14.8923 6.64173 4.88823 11.196 5.63555 8.9289 10.5303 8.12266 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 7.37327 6.64173 4.88823 9.55105 14.2334 10.1041 5.63555 8.9289 8.12266 9.43306 numMergedOcc 0
23 mol 181 unq 3 iso 1 dist 7.37327 9.55105 14.2334 6.64173 4.88823 10.1041 5.63555 8.9289 9.43306 8.12266 numMergedOcc 0
24 mol 181 unq 3 iso 0 dist 7.37327 9.01624 14.8923 9.55105 14.2334 3.55187 5.63555 8.9289 10.5303 9.43306 numMergedOcc 0
25 mol 181 unq 3 iso 1 dist 7.37327 9.55105 14.2334 9.01624 14.8923 3.55187 5.63555 8.9289 9.43306 10.5303 numMergedOcc 0
26 mol 188 unq 0 iso 0 dist 6.90541 7.88013 6.39872 9.90062 8.81694 3.68927 10.5721 9.33696 11.506 15.176 numMergedOcc 0
27 mol 188 unq 0 iso 1 dist 6.90541 9.90062 8.81694 7.88013 6.39872 3.68927 10.5721 9.33696 15.176 11.506 numMergedOcc 0
28 mol 192 unq 0 iso 0 dist 8.36822 9.78634 10.3099 5.64942 10.1087 5.9655 8.49529 7.33225 15.7529 13.3256 numMergedOcc 0
29 mol 192 unq 0 iso 1 dist 8.36822 5.64942 10.1087 9.78634 10.3099 5.9655 8.49529 7.33225 13.3256 15.7529 numMergedOcc 0
30 mol 192 unq 1 iso 0 dist 8.36822 9.78634 10.3099 7.43054 10.0566 7.70298 8.49529 7.33225 15.7529 13.7172 numMergedOcc 0
31 mol 192 unq 1 iso 1 dist 8.36822 7.43054 10.0566 9.78634 10.3099 7.70298 8.49529 7.33225 13.7172 15.7529 numMergedOcc 0
32 mol 192 unq 1 iso 0 dist 8.36822 5.64942 10.1087 7.43054 10.0566 3.60331 8.49529 7.33225 13.3256 13.7172 numMergedOcc 0
33 mol 192 unq 1 iso 1 dist 8.36822 7.43054 10.0566 5.64942 10.1087 3.60331 8.49529 7.33225 13.7172 13.3256 numMergedOcc 0
34 mol 235 unq 0 iso 0 dist 6.98084 8.19317 4.47008 6.29377 7.34601 4.8835 6.82855 7.31773 8.97952 10.1845 numMergedOcc 0
35 mol 235 unq 0 iso 1 dist 6.98084 6.29377 7.34601 8.19317 4.47008 4.8835 6.82855 7.31773 10.1845 8.97952 numMergedOcc 0
36 mol 235 unq 1 iso 0 dist 7.32211 5.1823 4.47008 5.70635 7.34601 4.8835 6.46722 7.31773 8.97952 10.1845 numMergedOcc 0
37 mol 235 unq 1 iso 1 dist 7.32211 5.70635 7.34601 5.1823 4.47008 4.8835 6.46722 7.31773 10.1845 8.97952 numMergedOcc 0
38 mol 259 unq 0 iso 0 dist 7.48005 9.63573 9.98303 7.66153 14.0829 10.3051 8.81835 8.71497 11.547 14.6679 numMergedOcc 0
39 mol 259 unq 0 iso 1 dist 7.48005 7.66153 14.0829 9.63573 9.98303 10.3051 8.81835 8.71497 14.6679 11.547 numMergedOcc 0
