0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 11.8172 11.0773 8.72114 10.5551 7.5706 6.04832 4.87279 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 8.72114 13.8829 11.8172 18.3807 6.02702 4.87279 8.70159 6.04832 10.5551 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 8.38064 7.07399 4.29582 11.0528 9.88835 5.89412 5.88545 7.876 9.41935 14.8121 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.86014 7.29868 8.52463 15.5315 15.5324 8.4051 4.99125 10.8237 6.23824 13.2525 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 10.0952 8.86116 8.60554 4.99125 10.8237 6.23824 11.4659 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.86116 8.60554 8.52463 14.6259 15.5324 8.4051 11.4659 10.8237 6.23824 13.2525 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 8.86116 8.60554 8.52463 10.0952 6.86014 7.29868 11.4659 10.8237 6.23824 4.99125 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 8.38394 8.60554 12.3994 14.6259 17.8264 8.4051 11.4659 16.0099 6.23824 13.2525 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 8.38394 8.60554 12.3994 10.0952 12.5077 7.29868 11.4659 16.0099 6.23824 4.99125 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 5.54419 8.4051 5.11617 15.5315 11.0194 7.29868 13.2525 9.40259 6.23824 4.99125 numMergedOcc 0
10 mol 24 unq 7 iso 0 dist 5.54419 8.4051 5.11617 14.6259 13.2433 8.60554 13.2525 9.40259 6.23824 11.4659 numMergedOcc 0
11 mol 24 unq 8 iso 0 dist 7.36323 8.4051 13.2229 15.5315 20.3888 7.29868 13.2525 18.5567 6.23824 4.99125 numMergedOcc 0
12 mol 24 unq 9 iso 0 dist 7.36323 8.4051 13.2229 14.6259 15.5296 8.60554 13.2525 18.5567 6.23824 11.4659 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 7.95579 7.54568 10.2865 10.1164 15.309 9.39864 11.3372 17.1126 8.60839 4.60756 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 6.19965 7.54568 8.09967 10.1164 11.2656 9.39864 11.3372 13.5621 8.60839 4.60756 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 7.66905 7.54568 4.65335 10.1164 5.73196 9.39864 11.3372 7.07868 8.60839 4.60756 numMergedOcc 0
16 mol 85 unq 3 iso 0 dist 5.73196 9.39864 4.65335 10.1164 7.66905 7.54568 4.60756 7.07868 8.60839 11.3372 numMergedOcc 0
17 mol 100 unq 0 iso 0 dist 9.60661 7.01812 5.80144 5.88134 6.65086 8.30845 8.07089 12.5743 6.84692 12.8256 numMergedOcc 0
18 mol 100 unq 1 iso 0 dist 7.17106 7.01812 8.4128 5.88134 10.5134 8.30845 8.07089 8.20656 6.84692 12.8256 numMergedOcc 0
19 mol 100 unq 2 iso 0 dist 9.35224 7.01812 10.0456 5.88134 6.56369 8.30845 8.07089 14.6339 6.84692 12.8256 numMergedOcc 0
20 mol 100 unq 3 iso 0 dist 7.47343 8.30845 12.2861 5.88134 12.0662 7.01812 12.8256 17.5797 6.84692 8.07089 numMergedOcc 0
21 mol 100 unq 4 iso 0 dist 6.65086 8.30845 5.80144 5.88134 9.60661 7.01812 12.8256 12.5743 6.84692 8.07089 numMergedOcc 0
22 mol 100 unq 5 iso 0 dist 6.56369 8.30845 10.0456 5.88134 9.35224 7.01812 12.8256 14.6339 6.84692 8.07089 numMergedOcc 0
23 mol 100 unq 6 iso 0 dist 9.30209 8.30845 6.70236 5.88134 10.5853 7.01812 12.8256 12.1782 6.84692 8.07089 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 6.29155 6.16242 4.54648 7.81217 6.80239 5.87634 5.47259 4.51266 6.49688 4.70102 numMergedOcc 0
25 mol 133 unq 1 iso 0 dist 6.80239 5.87634 4.54648 7.81217 6.29155 6.16242 4.70102 4.51266 6.49688 5.47259 numMergedOcc 0
26 mol 170 unq 0 iso 0 dist 9.76807 6.35982 4.34698 6.52462 12.8696 9.10511 9.77705 10.4619 8.20406 6.22427 numMergedOcc 0
27 mol 170 unq 1 iso 0 dist 9.76807 6.35982 4.34698 6.52462 12.8696 9.10511 5.36359 11.5324 7.19802 4.72207 numMergedOcc 0
28 mol 170 unq 2 iso 0 dist 9.76807 6.35982 4.34698 6.52462 12.8696 9.10511 8.84552 11.7022 7.75807 8.94639 numMergedOcc 0
29 mol 249 unq 0 iso 0 dist 7.57994 5.48118 10.7772 5.3927 12.8752 7.25858 6.66935 13.131 5.72442 5.78976 numMergedOcc 0
30 mol 249 unq 1 iso 0 dist 6.18582 5.48118 7.04666 5.3927 11.2388 7.25858 6.66935 9.60911 5.72442 5.78976 numMergedOcc 0
31 mol 258 unq 0 iso 0 dist 6.60405 7.21311 5.63675 12.321 10.5548 9.63959 4.88549 8.14531 7.05518 8.46375 numMergedOcc 0
32 mol 258 unq 1 iso 0 dist 6.60405 7.21311 5.63675 10.7374 14.3043 9.96262 4.88549 8.14531 7.05518 7.98112 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 7.56915 8.52587 5.29529 11.3308 11.3168 6.39866 5.87456 6.92434 5.0002 6.38211 numMergedOcc 0
