0 mol 11 unq 0 iso 0 dist 6.50001 3.77561 6.54358 4.46394 6.859 6.86684 5.95165 4.10106 4.61088 5.96346 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.36381 5.80023 7.27472 6.53276 4.44526 6.38336 9.54519 5.50396 7.36323 8.23446 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.36381 5.80023 7.27472 6.81998 9.586 6.7828 9.54519 5.50396 7.36323 8.75662 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.36381 5.80023 7.27472 6.81998 9.586 6.7828 12.511 14.4081 15.5296 9.44691 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.77745 5.8503 7.05196 4.32173 5.20109 7.33728 8.40051 5.63212 11.9561 6.16347 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 5.77745 5.8503 7.05196 4.32173 5.20109 7.33728 8.6396 6.47509 5.04899 7.45383 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.54368 5.1219 7.13008 9.64683 8.93769 10.9681 13.8027 6.95017 13.2315 7.52354 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 5.33961 11.1668 9.64383 9.96465 8.46823 16.4267 14.4342 10.4782 17.4071 6.65501 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 5.33961 12.7318 7.54889 9.96465 8.46823 9.67482 14.4342 10.4782 6.10456 6.65501 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 5.33961 12.3835 7.78931 9.96465 8.46823 12.0974 14.4342 10.4782 10.1136 6.65501 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 8.3505 4.75138 5.10496 7.43001 4.62494 4.4057 5.9747 3.9764 5.08437 6.65501 numMergedOcc 0
11 mol 98 unq 4 iso 0 dist 8.3505 10.4417 5.92242 7.43001 4.62494 7.42446 5.9747 3.9764 6.48948 6.65501 numMergedOcc 0
12 mol 98 unq 5 iso 0 dist 8.3505 11.3628 5.2571 7.43001 4.62494 9.67482 5.9747 3.9764 6.10456 6.65501 numMergedOcc 0
13 mol 98 unq 6 iso 0 dist 8.3505 13.9599 8.7497 7.43001 4.62494 12.0974 5.9747 3.9764 10.1136 6.65501 numMergedOcc 0
14 mol 98 unq 7 iso 0 dist 9.29816 5.70962 9.64383 13.7832 8.46823 16.4267 16.5524 10.4782 17.4071 6.65501 numMergedOcc 0
15 mol 98 unq 8 iso 0 dist 9.29816 14.676 7.54889 13.7832 8.46823 9.67482 16.5524 10.4782 6.10456 6.65501 numMergedOcc 0
16 mol 98 unq 9 iso 0 dist 9.29816 16.3389 7.78931 13.7832 8.46823 12.0974 16.5524 10.4782 10.1136 6.65501 numMergedOcc 0
17 mol 98 unq 10 iso 0 dist 5.08983 10.1978 9.64383 12.5752 8.46823 16.4267 12.3884 10.4782 17.4071 6.65501 numMergedOcc 0
18 mol 98 unq 11 iso 0 dist 5.08983 7.1452 7.54889 12.5752 8.46823 9.67482 12.3884 10.4782 6.10456 6.65501 numMergedOcc 0
19 mol 98 unq 12 iso 0 dist 5.08983 4.96747 7.78931 12.5752 8.46823 12.0974 12.3884 10.4782 10.1136 6.65501 numMergedOcc 0
20 mol 109 unq 0 iso 0 dist 9.46621 10.404 9.89083 4.03135 7.56755 10.0688 11.1103 5.00433 13.1098 7.80523 numMergedOcc 0
21 mol 109 unq 1 iso 0 dist 9.46621 10.6893 8.52024 4.03135 7.56755 7.74599 11.1103 5.00433 8.69985 7.80523 numMergedOcc 0
22 mol 109 unq 2 iso 0 dist 9.94704 14.8479 9.89083 4.81814 7.56755 10.0688 8.3164 5.00433 13.1098 7.80523 numMergedOcc 0
23 mol 109 unq 3 iso 0 dist 9.94704 11.5656 8.52024 4.81814 7.56755 7.74599 8.3164 5.00433 8.69985 7.80523 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 9.10803 12.7349 9.77575 6.49348 6.18678 6.36778 6.18763 9.85023 13.4378 8.00003 numMergedOcc 0
25 mol 129 unq 0 iso 0 dist 6.53559 6.43966 5.51197 4.92611 6.34626 4.92472 6.38163 6.28232 10.1333 7.58957 numMergedOcc 0
26 mol 129 unq 1 iso 0 dist 8.09774 5.56946 5.51197 6.15789 6.34626 4.92472 12.0922 6.28232 10.1333 7.58957 numMergedOcc 0
27 mol 155 unq 0 iso 0 dist 7.25009 10.4606 8.97626 8.61147 9.16358 5.50031 10.6076 4.91785 6.43582 7.92304 numMergedOcc 0
28 mol 155 unq 1 iso 0 dist 7.25009 10.4606 8.97626 5.45915 9.24038 6.89781 10.449 12.6999 12.3052 8.69157 numMergedOcc 0
29 mol 155 unq 2 iso 0 dist 7.25009 10.4606 8.97626 5.45915 9.24038 6.89781 4.44292 7.10286 10.7829 6.53347 numMergedOcc 0
30 mol 188 unq 0 iso 0 dist 7.6482 6.04074 7.88013 5.15888 8.66624 8.77113 11.4309 9.71636 13.353 7.14503 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 4.97796 4.56913 6.4611 6.70266 9.65868 9.5468 10.0379 14.7507 12.3938 7.46394 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 4.97796 4.56913 6.4611 6.70266 9.65868 9.5468 6.55855 8.87855 10.7806 9.45514 numMergedOcc 0
33 mol 274 unq 2 iso 0 dist 4.97796 4.56913 6.4611 6.70266 9.65868 9.5468 12.5213 12.5615 16.3286 8.91672 numMergedOcc 0
34 mol 274 unq 3 iso 0 dist 4.97796 4.56913 6.4611 6.70266 9.65868 9.5468 9.52894 13.0867 13.5896 7.1729 numMergedOcc 0
35 mol 274 unq 4 iso 0 dist 4.97796 4.56913 6.4611 5.15747 8.60027 6.70925 12.6706 16.9539 13.9359 8.52587 numMergedOcc 0
36 mol 274 unq 5 iso 0 dist 4.97796 4.56913 6.4611 5.15747 8.60027 6.70925 6.55855 8.87855 10.7806 6.39866 numMergedOcc 0
37 mol 274 unq 6 iso 0 dist 7.15079 4.37547 9.30212 9.95931 7.77765 9.5468 9.87411 5.22914 12.3938 7.46394 numMergedOcc 0
38 mol 274 unq 7 iso 0 dist 7.15079 4.37547 9.30212 9.95931 7.77765 9.5468 9.7198 12.393 10.7806 9.45514 numMergedOcc 0
39 mol 274 unq 8 iso 0 dist 7.15079 4.37547 9.30212 9.95931 7.77765 9.5468 17.4438 16.5034 16.3286 8.91672 numMergedOcc 0
40 mol 274 unq 9 iso 0 dist 7.15079 4.37547 9.30212 9.95931 7.77765 9.5468 11.9968 10.2884 13.5896 7.1729 numMergedOcc 0
