0 mol 34 unq 0 iso 0 dist 9.3613 5.73257 14.5006 6.20159 13.9758 7.48759 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.19567 7.84444 4.40061 9.92963 6.63532 10.0341 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.19567 7.84444 4.40061 8.07389 13.637 11.7792 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 9.34433 7.84444 11.3924 9.92963 12.7577 10.0341 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 9.34433 7.84444 11.3924 8.07389 6.33492 11.7792 numMergedOcc 0
5 mol 127 unq 0 iso 0 dist 9.70001 9.80337 7.46934 9.38764 5.78818 8.10285 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 7.10839 7.13287 4.85796 6.09084 4.7023 6.45748 numMergedOcc 0
7 mol 157 unq 0 iso 0 dist 6.53933 9.86043 3.75135 9.94725 8.29536 11.0228 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 8.3941 8.64561 7.60926 8.77346 10.2689 9.06228 numMergedOcc 0
9 mol 229 unq 0 iso 0 dist 5.99687 9.81585 7.90781 9.64316 5.67105 13.1362 numMergedOcc 0
10 mol 266 unq 0 iso 0 dist 6.20998 9.15288 5.18289 9.85095 4.86442 4.21036 numMergedOcc 0
11 mol 266 unq 1 iso 0 dist 6.20998 9.15288 5.18289 8.25191 12.138 14.1747 numMergedOcc 0
12 mol 266 unq 2 iso 0 dist 6.20998 9.15288 5.18289 7.35056 12.3665 13.7096 numMergedOcc 0
13 mol 266 unq 3 iso 0 dist 6.20998 6.11795 12.2123 9.85095 4.86442 15.6867 numMergedOcc 0
14 mol 266 unq 4 iso 0 dist 6.20998 6.11795 12.2123 8.25191 12.138 9.43694 numMergedOcc 0
15 mol 266 unq 5 iso 0 dist 6.20998 6.11795 12.2123 7.35056 12.3665 6.70962 numMergedOcc 0
16 mol 266 unq 6 iso 0 dist 8.78219 9.15288 15.1255 9.85095 13.5588 4.21036 numMergedOcc 0
17 mol 266 unq 7 iso 0 dist 8.78219 9.15288 15.1255 8.25191 11.0691 14.1747 numMergedOcc 0
18 mol 266 unq 8 iso 0 dist 8.78219 9.15288 15.1255 7.35056 12.7469 13.7096 numMergedOcc 0
19 mol 266 unq 9 iso 0 dist 8.78219 6.11795 12.0826 9.85095 13.5588 15.6867 numMergedOcc 0
20 mol 266 unq 10 iso 0 dist 8.78219 6.11795 12.0826 8.25191 11.0691 9.43694 numMergedOcc 0
21 mol 266 unq 11 iso 0 dist 8.78219 6.11795 12.0826 7.35056 12.7469 6.70962 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 7.29081 9.93542 10.5519 8.20612 11.9479 9.08 numMergedOcc 0
23 mol 280 unq 0 iso 0 dist 3.97964 6.78323 5.97333 8.89904 5.84126 6.07839 numMergedOcc 0
24 mol 280 unq 1 iso 0 dist 7.72152 6.78323 12.0122 8.89904 13.5533 6.07839 numMergedOcc 0
