0 mol 15 unq 0 iso 0 dist 5.89412 14.8121 9.41935 6.91314 6.23015 10.5167 11.3543 10.1154 11.4081 8.85174 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 7.07399 5.88545 9.41935 5.49251 6.23015 10.5167 10.6338 10.1154 11.4081 8.85174 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.4051 13.2525 6.23824 10.1698 6.61696 5.97274 5.54419 5.11617 9.40259 5.68215 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.4051 13.2525 6.23824 13.6174 5.80953 6.46192 15.5324 8.52463 10.8237 7.95042 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 7.29868 4.99125 6.23824 8.91183 6.61696 5.97274 11.0194 5.11617 9.40259 5.68215 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 7.29868 4.99125 6.23824 5.69214 5.80953 6.46192 6.86014 8.52463 10.8237 7.95042 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 8.60554 11.4659 6.23824 14.8647 6.61696 5.97274 13.2433 5.11617 9.40259 5.68215 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 8.60554 11.4659 6.23824 5.11636 5.80953 6.46192 8.86116 8.52463 10.8237 7.95042 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.27838 9.902 8.66571 5.69391 7.58875 4.81856 9.96708 11.6378 13.6124 9.55118 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 7.01812 8.07089 6.84692 4.03277 6.59691 8.59989 9.60661 5.80144 12.5743 8.91882 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 7.01812 8.07089 6.84692 4.03277 6.59691 8.59989 10.1489 5.42531 4.5985 9.21662 numMergedOcc 0
11 mol 100 unq 2 iso 0 dist 8.30845 12.8256 6.84692 6.23008 6.59691 8.59989 6.65086 5.80144 12.5743 8.91882 numMergedOcc 0
12 mol 100 unq 3 iso 0 dist 8.30845 12.8256 6.84692 6.23008 6.59691 8.59989 13.2001 5.42531 4.5985 9.21662 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 6.16242 5.47259 6.49688 13.0405 8.83732 13.2024 6.29155 4.54648 4.51266 8.77023 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 5.87634 4.70102 6.49688 13.7612 8.83732 13.2024 6.80239 4.54648 4.51266 8.77023 numMergedOcc 0
15 mol 170 unq 0 iso 0 dist 9.10511 6.22427 8.20406 4.12764 6.47164 5.40635 11.8841 9.275 6.36868 9.08274 numMergedOcc 0
16 mol 170 unq 1 iso 0 dist 9.10511 6.22427 8.20406 4.12764 6.47164 5.40635 12.8696 4.34698 10.4619 9.51256 numMergedOcc 0
17 mol 170 unq 2 iso 0 dist 9.10511 4.72207 7.19802 4.12764 6.47164 6.09207 11.8841 9.275 13.465 9.08274 numMergedOcc 0
18 mol 170 unq 3 iso 0 dist 9.10511 4.72207 7.19802 4.12764 6.47164 6.09207 12.8696 4.34698 11.5324 9.51256 numMergedOcc 0
19 mol 170 unq 4 iso 0 dist 9.10511 8.94639 7.75807 4.12764 6.47164 9.84933 11.8841 9.275 14.9766 9.08274 numMergedOcc 0
20 mol 170 unq 5 iso 0 dist 9.10511 8.94639 7.75807 4.12764 6.47164 9.84933 12.8696 4.34698 11.7022 9.51256 numMergedOcc 0
21 mol 170 unq 6 iso 0 dist 6.35982 9.77705 8.20406 4.78249 6.47164 5.40635 12.8281 9.275 6.36868 9.08274 numMergedOcc 0
22 mol 170 unq 7 iso 0 dist 6.35982 9.77705 8.20406 4.78249 6.47164 5.40635 9.76807 4.34698 10.4619 9.51256 numMergedOcc 0
23 mol 170 unq 8 iso 0 dist 6.35982 5.36359 7.19802 4.78249 6.47164 6.09207 12.8281 9.275 13.465 9.08274 numMergedOcc 0
24 mol 170 unq 9 iso 0 dist 6.35982 5.36359 7.19802 4.78249 6.47164 6.09207 9.76807 4.34698 11.5324 9.51256 numMergedOcc 0
25 mol 170 unq 10 iso 0 dist 6.35982 8.84552 7.75807 4.78249 6.47164 9.84933 12.8281 9.275 14.9766 9.08274 numMergedOcc 0
26 mol 170 unq 11 iso 0 dist 6.35982 8.84552 7.75807 4.78249 6.47164 9.84933 9.76807 4.34698 11.7022 9.51256 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 6.46704 5.87996 8.91675 6.50233 7.35884 4.46602 8.03334 4.43096 12.0793 9.76212 numMergedOcc 0
28 mol 181 unq 1 iso 0 dist 6.46704 5.87996 8.91675 6.50233 7.35884 4.46602 10.9639 6.06566 12.2582 8.59874 numMergedOcc 0
29 mol 181 unq 2 iso 0 dist 5.9176 5.83639 6.2176 10.6474 8.12266 7.11838 7.63312 5.63555 8.47008 6.64173 numMergedOcc 0
30 mol 181 unq 3 iso 0 dist 5.9176 5.83639 6.2176 5.12833 9.43306 5.42919 7.63312 5.63555 8.47008 9.55105 numMergedOcc 0
31 mol 188 unq 0 iso 0 dist 7.14503 5.22586 6.65177 9.71636 8.66624 10.8586 13.353 8.77113 14.6394 7.88013 numMergedOcc 0
32 mol 234 unq 0 iso 0 dist 7.32499 13.1319 9.38888 13.1872 7.77911 4.76962 10.3625 10.0059 6.35438 7.81215 numMergedOcc 0
33 mol 234 unq 1 iso 0 dist 7.32499 13.1319 9.38888 13.1872 7.77911 4.76962 11.0622 5.08515 9.57132 5.64285 numMergedOcc 0
34 mol 273 unq 0 iso 0 dist 8.83865 9.75887 6.83684 8.56043 6.35532 4.04219 13.3579 4.60101 9.82018 9.59325 numMergedOcc 0
35 mol 273 unq 1 iso 0 dist 9.18157 7.29345 6.83684 8.81454 6.35532 4.04219 13.4294 4.60101 9.82018 9.59325 numMergedOcc 0
36 mol 274 unq 0 iso 0 dist 7.46394 10.0578 7.1364 5.22914 7.77765 13.3529 12.3938 9.5468 15.7342 9.30212 numMergedOcc 0
37 mol 274 unq 1 iso 0 dist 7.46394 10.0578 7.1364 14.7507 9.65868 13.7073 12.3938 9.5468 15.7342 6.4611 numMergedOcc 0
38 mol 274 unq 2 iso 0 dist 9.45514 10.0247 7.1364 12.393 7.77765 13.3529 10.7806 9.5468 15.7342 9.30212 numMergedOcc 0
39 mol 274 unq 3 iso 0 dist 9.45514 10.0247 7.1364 8.87855 9.65868 13.7073 10.7806 9.5468 15.7342 6.4611 numMergedOcc 0
40 mol 274 unq 4 iso 0 dist 8.91672 5.25703 7.1364 16.5034 7.77765 13.3529 16.3286 9.5468 15.7342 9.30212 numMergedOcc 0
41 mol 274 unq 5 iso 0 dist 8.91672 5.25703 7.1364 12.5615 9.65868 13.7073 16.3286 9.5468 15.7342 6.4611 numMergedOcc 0
42 mol 274 unq 6 iso 0 dist 7.1729 5.56942 7.1364 10.2884 7.77765 13.3529 13.5896 9.5468 15.7342 9.30212 numMergedOcc 0
43 mol 274 unq 7 iso 0 dist 7.1729 5.56942 7.1364 13.0867 9.65868 13.7073 13.5896 9.5468 15.7342 6.4611 numMergedOcc 0
44 mol 274 unq 8 iso 0 dist 8.52587 5.87456 5.0002 16.9539 8.60027 12.616 13.9359 6.70925 11.6681 6.4611 numMergedOcc 0
45 mol 274 unq 9 iso 0 dist 6.39866 6.38211 5.0002 8.87855 8.60027 12.616 10.7806 6.70925 11.6681 6.4611 numMergedOcc 0
