0 mol 11 unq 0 iso 0 dist 5.95165 6.50001 4.10106 4.46394 5.96346 6.859 3.77561 4.61088 6.54358 6.86684 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.54519 6.36381 5.50396 12.1061 8.4051 9.84204 5.80023 7.36323 7.27472 13.2229 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.54519 6.36381 5.50396 6.53276 8.23446 4.44526 5.80023 7.36323 7.27472 6.38336 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 9.54519 6.36381 5.50396 6.81998 8.75662 9.586 5.80023 7.36323 7.27472 6.7828 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.40051 5.77745 5.63212 4.32173 6.16347 5.20109 5.8503 11.9561 7.05196 7.33728 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 8.40051 5.77745 5.63212 15.9662 7.92503 13.0308 5.8503 11.9561 7.05196 19.1927 numMergedOcc 0
6 mol 25 unq 2 iso 0 dist 8.6396 5.77745 6.47509 4.32173 7.45383 5.20109 5.8503 5.04899 7.05196 7.33728 numMergedOcc 0
7 mol 25 unq 3 iso 0 dist 8.6396 5.77745 6.47509 16.0077 9.01548 12.506 5.8503 5.04899 7.05196 13.9331 numMergedOcc 0
8 mol 25 unq 4 iso 0 dist 8.88413 8.27137 11.4148 10.7087 7.55264 9.35791 5.59268 7.17969 4.79873 6.08585 numMergedOcc 0
9 mol 25 unq 5 iso 0 dist 7.63928 8.27137 14.321 9.78075 6.85556 16.7474 5.59268 11.6743 4.79873 15.1839 numMergedOcc 0
10 mol 56 unq 0 iso 0 dist 7.20538 7.93171 9.96534 3.63144 7.16773 11.1705 7.82856 14.5295 9.2898 10.697 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 5.9747 8.3505 3.9764 7.43001 6.65501 4.62494 4.75138 5.08437 5.10496 4.4057 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 5.9747 8.3505 3.9764 7.43001 6.65501 4.62494 10.4417 6.48948 5.92242 7.42446 numMergedOcc 0
13 mol 98 unq 2 iso 0 dist 5.9747 8.3505 3.9764 7.43001 6.65501 4.62494 11.3628 6.10456 5.2571 9.67482 numMergedOcc 0
14 mol 98 unq 3 iso 0 dist 5.9747 8.3505 3.9764 7.43001 6.65501 4.62494 13.9599 10.1136 8.7497 12.0974 numMergedOcc 0
15 mol 98 unq 4 iso 0 dist 5.9747 7.34638 7.03983 7.43001 6.65501 9.84743 10.4417 6.48948 7.02507 7.42446 numMergedOcc 0
16 mol 98 unq 5 iso 0 dist 4.50572 6.0995 7.03983 9.5305 6.65501 9.84743 9.63267 6.48948 7.02507 7.42446 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 8.3164 9.94704 5.00433 4.81814 7.80523 7.56755 14.8479 13.1098 9.89083 10.0688 numMergedOcc 0
18 mol 109 unq 1 iso 0 dist 8.3164 9.94704 5.00433 4.81814 7.80523 7.56755 11.5656 8.69985 8.52024 7.74599 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 6.18763 9.10803 9.85023 6.49348 8.00003 6.18678 12.7349 13.4378 9.77575 6.36778 numMergedOcc 0
20 mol 119 unq 1 iso 0 dist 8.44385 9.10803 12.4829 4.01593 9.11344 12.1689 12.7349 19.9505 9.77575 14.8262 numMergedOcc 0
21 mol 119 unq 2 iso 0 dist 5.63005 9.10803 8.84069 4.01593 6.52773 12.1689 12.7349 15.7043 9.77575 14.8262 numMergedOcc 0
22 mol 119 unq 3 iso 0 dist 5.63005 9.10803 8.84069 13.1254 9.23858 12.2731 12.7349 15.7043 9.77575 17.5392 numMergedOcc 0
23 mol 129 unq 0 iso 0 dist 6.38163 6.53559 6.28232 7.03404 6.28565 10.9495 6.43966 10.1333 5.51197 12.1808 numMergedOcc 0
24 mol 129 unq 1 iso 0 dist 6.38163 6.53559 6.28232 4.92611 7.58957 6.34626 6.43966 10.1333 5.51197 4.92472 numMergedOcc 0
25 mol 129 unq 2 iso 0 dist 6.38163 7.90844 12.3705 7.03404 6.28565 14.5783 6.43966 10.1333 8.86944 12.1808 numMergedOcc 0
26 mol 129 unq 3 iso 0 dist 6.38163 7.90844 12.3705 4.92611 7.58957 11.4468 6.43966 10.1333 8.86944 4.92472 numMergedOcc 0
27 mol 131 unq 0 iso 0 dist 6.31125 9.10434 3.98662 11.127 9.90168 10.0568 5.6098 8.40312 9.27976 7.7567 numMergedOcc 0
28 mol 155 unq 0 iso 0 dist 4.44292 7.25009 7.10286 5.45915 6.53347 9.24038 10.4606 10.7829 8.97626 6.89781 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 6.55855 4.97796 8.87855 6.70266 9.45514 9.65868 4.56913 10.7806 6.4611 9.5468 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 6.55855 4.97796 8.87855 5.15747 6.39866 8.60027 4.56913 10.7806 6.4611 6.70925 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 9.52894 4.97796 13.0867 6.70266 7.1729 9.65868 4.56913 13.5896 6.4611 9.5468 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 9.71801 7.15079 11.4471 4.36131 8.52587 10.0206 4.37547 13.9359 9.30212 6.70925 numMergedOcc 0
