0 mol 5 unq 0 iso 0 dist 9.58876 9.05086 8.68577 14.8789 10.4477 8.87945 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.37411 9.00405 7.47395 11.2079 4.7579 7.99756 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 9.37411 9.00405 7.47395 8.98326 3.21365 4.36087 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 5.42968 4.30555 8.25818 6.6834 11.1587 7.7447 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 8.33405 9.36667 9.13228 14.6378 10.1907 8.78414 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 7.51631 8.24064 7.7485 6.09085 7.18877 8.71074 numMergedOcc 0
6 mol 107 unq 0 iso 0 dist 7.09988 7.96442 8.88124 10.9355 5.88785 7.91251 numMergedOcc 0
7 mol 107 unq 1 iso 0 dist 7.09988 14.3565 8.19484 10.9355 5.88785 9.09262 numMergedOcc 0
8 mol 107 unq 2 iso 0 dist 7.73898 6.37998 8.88124 10.4236 5.88785 7.91251 numMergedOcc 0
9 mol 107 unq 3 iso 0 dist 7.73898 11.5335 8.19484 10.4236 5.88785 9.09262 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 6.61697 5.70681 5.31126 12.4669 9.59189 8.67025 numMergedOcc 0
11 mol 113 unq 1 iso 0 dist 6.61697 5.08157 7.16619 14.6461 13.8379 9.60127 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 9.60192 10.5073 6.21029 13.7888 7.30495 9.45013 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 8.83566 6.28158 6.55227 8.71812 3.43966 7.54274 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.85177 5.73931 5.10589 12.8818 9.60496 8.6961 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 8.88729 5.73931 4.63336 12.8818 10.5251 8.6961 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 7.07933 12.9917 6.96715 8.89822 3.59996 4.11374 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 8.47283 10.816 9.93489 6.51936 4.05102 7.33774 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 8.47283 4.27546 7.64057 6.51936 4.05102 6.39122 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 7.93054 4.26898 7.42759 6.28826 4.16963 6.50654 numMergedOcc 0
20 mol 254 unq 0 iso 0 dist 8.26189 12.399 7.85841 15.8086 8.8967 5.6417 numMergedOcc 0
21 mol 254 unq 1 iso 0 dist 8.26189 12.399 7.85841 15.7396 9.42679 7.42831 numMergedOcc 0
22 mol 254 unq 2 iso 0 dist 7.57834 12.6878 9.20109 15.7954 10.929 5.6417 numMergedOcc 0
23 mol 254 unq 3 iso 0 dist 7.57834 12.6878 9.20109 14.7701 10.706 7.42831 numMergedOcc 0
24 mol 254 unq 4 iso 0 dist 5.75348 12.399 9.20109 15.8086 10.929 5.6417 numMergedOcc 0
25 mol 254 unq 5 iso 0 dist 5.75348 12.399 9.20109 15.7396 10.706 7.42831 numMergedOcc 0
26 mol 260 unq 0 iso 0 dist 8.90109 8.71923 7.04263 14.8324 8.22506 8.51564 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 5.93983 8.32005 5.88958 7.12723 3.14843 4.27826 numMergedOcc 0
28 mol 285 unq 1 iso 0 dist 5.93983 7.07384 7.78121 7.12723 3.14843 5.82074 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 8.27196 4.69872 6.24487 11.1329 5.55422 8.32982 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 8.27196 4.69872 6.24487 11.1329 5.55422 8.32982 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 8.27196 4.69872 6.24487 11.1329 5.55422 8.32982 numMergedOcc 0
