0 mol 0 unq 0 iso 0 dist 7.96742 5.55156 11.962 7.1599 15.0192 7.15528 12.1007 19.7325 9.19662 6.26831 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.24206 9.5614 13.3337 5.25456 7.37981 7.15528 10.0273 6.58151 9.19662 6.26831 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 9.5614 6.83587 5.25456 7.19621 7.15528 10.0273 8.69991 9.19662 6.26831 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19397 5.55156 6.83587 7.1599 7.19621 7.15528 12.1007 8.69991 9.19662 6.26831 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 7.15287 13.8674 8.41585 12.0214 15.6665 10.2446 7.88043 numMergedOcc 0
5 mol 7 unq 1 iso 0 dist 8.41173 6.22892 6.3027 7.15287 13.8674 8.41585 11.7931 16.6966 12.3097 8.80762 numMergedOcc 0
6 mol 60 unq 0 iso 0 dist 9.54864 8.8058 6.0993 5.09908 11.9912 8.33063 8.4928 10.5228 9.62257 9.96399 numMergedOcc 0
7 mol 60 unq 1 iso 0 dist 9.54864 8.8058 6.0993 10.0675 13.4395 8.7531 8.4928 10.5228 9.62257 7.55695 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 6.89762 11.5472 6.45675 14.5893 16.096 11.8512 9.00544 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 6.60356 9.57498 14.3495 6.89762 11.5472 6.45675 6.14415 6.04919 9.52882 7.12017 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 9.42175 5.81552 9.60908 10.626 14.3405 9.60462 19.0535 24.0749 17.3924 9.92283 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 9.42175 5.81552 9.60908 10.626 14.3405 9.60462 6.48223 7.99528 3.98564 7.23962 numMergedOcc 0
12 mol 112 unq 2 iso 0 dist 9.42175 5.81552 9.60908 5.27363 13.2326 7.45389 6.48223 7.99528 3.98564 7.30204 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 5.31281 9.24515 7.18757 5.24877 8.42445 7.5732 7.73842 10.9798 11.128 6.34525 numMergedOcc 0
14 mol 114 unq 1 iso 0 dist 8.9922 9.24515 7.13921 5.24877 10.2889 7.5732 7.73842 15.009 11.128 6.34525 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 7.9663 9.05626 9.97628 7.09664 12.0527 8.70949 4.85559 4.79695 5.97111 8.33077 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 13.0547 17.3548 12.7056 8.41611 numMergedOcc 0
17 mol 143 unq 1 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 13.9236 15.8331 12.8872 7.63338 numMergedOcc 0
18 mol 143 unq 2 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 12.3804 12.3147 7.76364 9.03707 numMergedOcc 0
19 mol 143 unq 3 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 12.697 12.2045 9.23795 7.25673 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 6.43585 6.86297 5.43796 7.56632 10.9329 9.09754 12.4751 10.763 9.97575 8.64409 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 6.24111 8.07523 5.82028 13.3929 9.67457 6.18308 17.6094 13.9851 9.59996 5.37446 numMergedOcc 0
22 mol 210 unq 1 iso 0 dist 9.00343 7.56882 5.82028 12.3088 9.67457 6.18308 16.1367 13.9851 9.59996 5.37446 numMergedOcc 0
23 mol 210 unq 2 iso 0 dist 8.60412 8.07523 4.62641 13.3929 9.90494 6.18308 17.6094 11.7432 9.59996 5.37446 numMergedOcc 0
24 mol 210 unq 3 iso 0 dist 7.05535 7.56882 4.62641 12.3088 9.90494 6.18308 16.1367 11.7432 9.59996 5.37446 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 6.74214 7.98022 6.62361 6.3873 9.31417 5.72887 12.6187 16.0652 12.3808 7.32982 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 5.33462 7.98022 5.96552 6.3873 5.56719 5.72887 12.6187 11.468 12.3808 7.32982 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 6.08181 8.81059 13.8694 9.78068 15.2652 6.42289 14.0614 18.7969 5.27959 9.53063 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 7.70189 8.81059 9.22664 9.78068 8.58088 6.42289 14.0614 13.2039 5.27959 9.53063 numMergedOcc 0
29 mol 272 unq 0 iso 0 dist 7.50321 4.78812 5.96981 5.27123 12.4617 8.33638 7.11691 9.0626 8.7909 8.46061 numMergedOcc 0
30 mol 272 unq 1 iso 0 dist 7.50321 6.62923 7.55961 11.9042 16.9946 9.97651 7.11691 9.0626 4.86504 9.64269 numMergedOcc 0
31 mol 272 unq 2 iso 0 dist 7.50321 6.62923 7.55961 5.27123 12.4617 8.46116 7.11691 9.0626 4.86504 8.46061 numMergedOcc 0
32 mol 272 unq 3 iso 0 dist 9.61597 4.78812 6.76845 5.27123 13.2205 8.33638 7.11691 8.41005 8.7909 8.46061 numMergedOcc 0
33 mol 272 unq 4 iso 0 dist 9.61597 6.62923 5.43733 11.9042 15.2989 9.97651 7.11691 8.41005 4.86504 9.64269 numMergedOcc 0
34 mol 272 unq 5 iso 0 dist 9.61597 6.62923 5.43733 5.27123 13.2205 8.46116 7.11691 8.41005 4.86504 8.46061 numMergedOcc 0
