0 mol 37 unq 0 iso 0 dist 8.40835 9.7385 12.0019 9.19231 13.6649 9.86496 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 7.30392 6.42645 13.0684 9.56193 16.136 7.01397 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 5.72494 7.85115 11.4876 4.90013 9.97835 9.0807 numMergedOcc 0
3 mol 103 unq 1 iso 0 dist 5.72494 7.85115 11.4876 15.1802 17.7065 9.70231 numMergedOcc 0
4 mol 103 unq 2 iso 0 dist 8.70106 7.85115 11.2795 4.90013 10.844 9.0807 numMergedOcc 0
5 mol 103 unq 3 iso 0 dist 8.70106 7.85115 11.2795 15.1802 13.3612 9.70231 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 8.60157 7.91749 3.54257 6.76353 8.6953 9.0735 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 6.72591 7.91749 8.03052 6.76353 9.18753 9.0735 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 8.59359 7.96309 3.59609 6.65519 8.65967 9.03593 numMergedOcc 0
9 mol 150 unq 1 iso 0 dist 6.80192 7.96309 8.06512 6.65519 9.15244 9.03593 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 6.45502 4.80508 7.82494 8.67293 14.1665 9.98554 numMergedOcc 0
11 mol 158 unq 1 iso 0 dist 6.45502 4.88625 5.34159 10.8391 10.6047 9.04564 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 5.04534 6.4503 6.22764 5.73847 7.21397 8.00005 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 6.6514 8.87575 11.6251 6.73015 12.2548 9.98672 numMergedOcc 0
14 mol 167 unq 1 iso 0 dist 6.6514 8.87575 11.6251 6.63124 12.8904 7.84707 numMergedOcc 0
15 mol 182 unq 0 iso 0 dist 7.03216 8.43599 5.28013 4.60682 8.27913 9.75791 numMergedOcc 0
16 mol 182 unq 1 iso 0 dist 9.42196 8.43599 5.89583 4.60682 8.85111 9.75791 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 9.67207 8.42665 9.82858 4.64973 6.2016 7.97601 numMergedOcc 0
18 mol 198 unq 0 iso 0 dist 8.74957 9.50184 5.46544 4.61344 9.87574 7.95437 numMergedOcc 0
19 mol 198 unq 1 iso 0 dist 7.91967 6.49746 5.46544 9.72265 9.87574 7.95437 numMergedOcc 0
20 mol 233 unq 0 iso 0 dist 7.5099 9.63067 9.59315 9.93927 14.7605 7.97911 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 9.73281 8.4346 11.7618 9.57287 18.3708 9.672 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 9.73281 7.97728 11.7378 9.57287 18.3708 9.15233 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 8.0652 9.97709 16.9357 13.8349 21.8799 8.50998 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 6.15396 8.36459 4.4471 5.668 5.00258 7.21879 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 9.18964 8.36459 10.1631 5.668 8.22117 7.21879 numMergedOcc 0
