0 mol 5 unq 0 iso 0 dist 7.44029 4.07788 7.95876 11.6519 7.74636 10.0149 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 6.50001 3.77561 6.54358 9.80646 9.89425 9.68636 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 9.97769 4.41883 8.111 4.47278 5.7147 3.75721 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.90986 14.3129 9.12845 3.30063 8.97754 11.5008 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.81143 9.84195 7.18022 5.85133 9.41098 13.1004 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 7.57749 14.3993 9.9787 9.83606 5.4713 10.6814 numMergedOcc 0
6 mol 46 unq 1 iso 0 dist 8.55202 4.53545 9.9787 8.99132 5.4713 10.6814 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 5.40748 8.17272 7.28228 10.3937 9.32314 4.32161 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 6.63973 9.42791 8.23026 9.68005 5.45099 4.27653 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 6.63973 9.42791 8.23026 14.6547 8.44765 10.934 numMergedOcc 0
10 mol 76 unq 2 iso 0 dist 6.63973 9.42791 8.23026 14.1202 9.06643 11.8887 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 7.34638 10.4417 7.02507 13.4072 7.14813 9.71703 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 6.0995 9.63267 7.02507 13.2035 7.14813 9.71703 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 6.12348 14.0364 8.80934 3.77247 4.30875 13.0914 numMergedOcc 0
14 mol 113 unq 1 iso 0 dist 6.12348 14.0364 8.80934 13.3539 8.65807 12.5818 numMergedOcc 0
15 mol 113 unq 2 iso 0 dist 7.2672 12.1308 8.80934 7.80142 4.30875 13.0914 numMergedOcc 0
16 mol 113 unq 3 iso 0 dist 7.2672 12.1308 8.80934 6.39991 8.65807 12.5818 numMergedOcc 0
17 mol 127 unq 0 iso 0 dist 8.75894 4.70935 6.08673 4.58529 8.09691 3.97136 numMergedOcc 0
18 mol 139 unq 0 iso 0 dist 7.02063 5.30274 5.80789 3.57097 8.83962 6.10392 numMergedOcc 0
19 mol 168 unq 0 iso 0 dist 7.30338 12.1014 6.02086 7.13766 8.21227 12.7437 numMergedOcc 0
20 mol 184 unq 0 iso 0 dist 8.27396 4.41193 5.96423 9.10254 5.23187 5.03539 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 6.52441 11.7795 7.2793 12.7948 9.34653 4.04122 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 8.70029 6.45947 8.83833 5.73371 7.80473 10.9989 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 9.13546 11.5671 9.19754 14.0586 9.87744 10.1415 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 9.13546 13.8765 8.29262 14.0586 9.87744 11.5587 numMergedOcc 0
25 mol 264 unq 2 iso 0 dist 7.19658 5.21164 9.19754 5.51231 9.87744 10.1415 numMergedOcc 0
26 mol 264 unq 3 iso 0 dist 7.19658 6.12009 8.29262 5.51231 9.87744 11.5587 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 5.09181 4.16039 7.80862 5.00843 7.73438 8.33646 numMergedOcc 0
