0 mol 27 unq 0 iso 0 dist 7.96312 5.24778 7.18409 12.0951 6.21163 8.47362 numMergedOcc 0
1 mol 27 unq 0 iso 1 dist 7.96312 12.0951 6.21163 5.24778 7.18409 8.47362 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.67129 7.83976 7.18409 12.7455 6.21163 8.47362 numMergedOcc 0
3 mol 27 unq 1 iso 1 dist 7.67129 12.7455 6.21163 7.83976 7.18409 8.47362 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 9.89804 17.7567 9.95327 5.50549 7.50825 15.1044 numMergedOcc 0
5 mol 55 unq 0 iso 1 dist 9.89804 5.50549 7.50825 17.7567 9.95327 15.1044 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 6.62527 5.6352 8.36678 7.68024 6.39634 6.04827 numMergedOcc 0
7 mol 126 unq 0 iso 1 dist 6.62527 7.68024 6.39634 5.6352 8.36678 6.04827 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 8.49831 6.78674 9.62138 5.79944 5.11444 5.72609 numMergedOcc 0
9 mol 152 unq 0 iso 1 dist 8.49831 5.79944 5.11444 6.78674 9.62138 5.72609 numMergedOcc 0
10 mol 153 unq 0 iso 0 dist 9.74877 3.9641 9.73965 6.80289 8.89027 7.68167 numMergedOcc 0
11 mol 153 unq 0 iso 1 dist 9.74877 6.80289 8.89027 3.9641 9.73965 7.68167 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 8.2232 11.3094 6.69623 9.69198 6.21951 7.07077 numMergedOcc 0
13 mol 206 unq 0 iso 1 dist 8.2232 9.69198 6.21951 11.3094 6.69623 7.07077 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 6.07229 8.73597 6.69623 4.95828 6.21951 7.07077 numMergedOcc 0
15 mol 206 unq 1 iso 1 dist 6.07229 4.95828 6.21951 8.73597 6.69623 7.07077 numMergedOcc 0
16 mol 217 unq 0 iso 0 dist 7.63191 5.21449 6.14304 6.36283 9.95995 8.11193 numMergedOcc 0
17 mol 217 unq 0 iso 1 dist 7.63191 6.36283 9.95995 5.21449 6.14304 8.11193 numMergedOcc 0
18 mol 230 unq 0 iso 0 dist 9.07808 5.98989 8.58275 7.70123 8.78693 4.34904 numMergedOcc 0
19 mol 230 unq 0 iso 1 dist 9.07808 7.70123 8.78693 5.98989 8.58275 4.34904 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 9.6427 4.76856 8.43762 11.0792 9.39754 6.59047 numMergedOcc 0
21 mol 241 unq 0 iso 1 dist 9.6427 11.0792 9.39754 4.76856 8.43762 6.59047 numMergedOcc 0
22 mol 241 unq 1 iso 0 dist 7.82708 5.37459 8.43762 5.02153 9.39754 6.59047 numMergedOcc 0
23 mol 241 unq 1 iso 1 dist 7.82708 5.02153 9.39754 5.37459 8.43762 6.59047 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.61452 9.69939 8.79637 12.0301 8.88458 8.47795 numMergedOcc 0
25 mol 279 unq 0 iso 1 dist 8.61452 12.0301 8.88458 9.69939 8.79637 8.47795 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 7.14502 12.6882 9.7659 9.06411 6.1268 12.3345 numMergedOcc 0
27 mol 294 unq 0 iso 1 dist 7.14502 9.06411 6.1268 12.6882 9.7659 12.3345 numMergedOcc 0
