0 mol 19 unq 0 iso 0 dist 8.58657 6.41423 5.90856 7.7312 9.61438 5.31883 7.07775 9.80108 10.741 14.2009 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 9.4278 13.4402 4.97525 7.08557 9.33535 13.2397 16.4015 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 8.63333 9.92355 12.0055 9.23438 4.43437 8.76454 5.35073 8.89374 7.68678 7.17488 numMergedOcc 0
3 mol 58 unq 2 iso 0 dist 8.63333 9.92355 12.0055 9.23438 4.43437 8.76454 10.8153 6.46761 14.171 6.79356 numMergedOcc 0
4 mol 58 unq 3 iso 0 dist 8.63333 9.92355 12.0055 9.23438 4.43437 8.76454 14.5953 9.73139 20.1318 12.2384 numMergedOcc 0
5 mol 58 unq 4 iso 0 dist 8.89374 7.68678 12.0055 7.17488 4.43437 8.76454 5.35073 8.63333 9.92355 9.23438 numMergedOcc 0
6 mol 58 unq 5 iso 0 dist 8.89374 7.68678 12.0055 7.17488 4.43437 8.76454 8.62958 6.46761 14.171 6.79356 numMergedOcc 0
7 mol 58 unq 6 iso 0 dist 8.89374 7.68678 12.0055 7.17488 4.43437 8.76454 14.176 9.73139 20.1318 12.2384 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 6.77912 9.27838 4.67641 4.86198 10.4337 13.6186 5.36766 8.624 11.1896 8.26541 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 8.71128 6.84011 9.23527 9.93438 5.80637 5.99273 5.59517 7.52743 10.0237 10.7946 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 6.79146 7.88805 6.08911 9.81269 9.6361 3.88766 7.01619 7.66168 7.90048 10.8305 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 6.79146 7.88805 6.08911 9.81269 9.6361 3.88766 6.83397 6.89257 11.5527 14.8481 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 6.91348 8.70296 9.93183 8.80895 6.25029 5.92118 6.63273 8.6243 12.6227 12.9064 numMergedOcc 0
13 mol 131 unq 1 iso 0 dist 6.91348 9.25558 5.90177 8.80895 6.25029 10.2176 6.63273 8.6243 11.586 12.9064 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 9.52936 6.42735 7.4793 9.84566 4.11581 5.05856 5.43299 9.15417 10.3218 11.546 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 9.52936 6.42735 7.4793 8.22001 12.4034 5.69882 5.43299 9.15417 10.3218 13.1877 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 6.47873 8.65535 10.7231 9.52922 13.3106 3.7326 8.48054 8.38695 13.9101 14.7929 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 9.59129 7.37798 12.1116 8.82761 14.9475 15.5804 13.7995 8.45368 16.5606 19.0008 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 9.59129 7.73322 9.93085 8.82761 14.9475 6.78109 13.7995 8.45368 16.3542 19.0008 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 7.17547 6.1951 7.21048 6.1896 10.7049 5.34495 7.83217 7.13323 10.8165 13.5775 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 7.17547 6.1951 7.21048 6.09255 4.36581 3.83106 7.83217 7.13323 10.8165 10.0144 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 9.58736 9.55668 13.128 8.08965 14.2299 6.82702 9.85037 9.43058 10.076 14.4487 numMergedOcc 0
22 mol 235 unq 1 iso 0 dist 9.58736 9.55668 13.128 8.08965 14.2299 6.82702 13.6669 8.75735 14.3922 18.6146 numMergedOcc 0
23 mol 235 unq 2 iso 0 dist 9.58736 9.55668 13.128 8.08965 14.2299 6.82702 16.4493 6.98084 18.022 19.6952 numMergedOcc 0
24 mol 235 unq 3 iso 0 dist 9.58736 9.55668 13.128 8.08965 14.2299 6.82702 15.4 7.32211 20.3456 21.1783 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 8.94231 3.94343 13.4894 5.6348 8.09066 7.02333 8.88652 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 6.05141 8.94014 11.5793 8.94231 3.94343 13.4894 8.87326 7.2766 8.67864 6.46771 numMergedOcc 0
27 mol 238 unq 2 iso 0 dist 8.14172 7.02333 4.38002 8.88652 12.0336 13.4894 5.31152 6.77463 8.67864 6.46771 numMergedOcc 0
28 mol 238 unq 3 iso 0 dist 8.09066 7.02333 11.5793 8.88652 3.94343 13.4894 5.6348 6.05141 8.94014 8.94231 numMergedOcc 0
29 mol 238 unq 4 iso 0 dist 8.09066 7.02333 11.5793 8.88652 3.94343 13.4894 5.31152 7.2766 8.67864 6.46771 numMergedOcc 0
30 mol 238 unq 5 iso 0 dist 6.77463 8.67864 4.38002 6.46771 12.0336 13.4894 5.31152 8.14172 7.02333 8.88652 numMergedOcc 0
31 mol 238 unq 6 iso 0 dist 7.2766 8.67864 11.5793 6.46771 3.94343 13.4894 8.87326 6.05141 8.94014 8.94231 numMergedOcc 0
32 mol 238 unq 7 iso 0 dist 7.2766 8.67864 11.5793 6.46771 3.94343 13.4894 5.31152 8.09066 7.02333 8.88652 numMergedOcc 0
33 mol 240 unq 0 iso 0 dist 6.15305 6.68687 9.66581 5.77749 6.06674 7.06594 4.28414 7.03489 10.5594 9.30946 numMergedOcc 0
