0 mol 51 unq 0 iso 0 dist 9.66898 8.55004 4.9987 11.5172 13.9599 9.4097 7.23303 11.1832 7.73836 4.98392 numMergedOcc 0
1 mol 129 unq 0 iso 0 dist 9.0455 7.13958 5.0466 4.99299 8.63018 7.07421 9.05571 8.09774 8.85652 4.79473 numMergedOcc 0
2 mol 129 unq 1 iso 0 dist 9.0455 7.13958 5.0466 4.99299 8.63018 7.07421 9.63308 11.4776 9.31543 5.04019 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 8.80041 9.92685 5.11455 6.40926 10.2168 7.9663 12.989 13.4172 9.67398 9.69908 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.64946 7.17051 5.57746 5.80658 5.68599 5.12189 3.75291 9.76097 5.9959 6.95933 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 8.64946 7.17051 5.57746 8.58899 12.0133 7.50126 3.75291 9.76097 5.9959 5.30466 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 8.59783 6.20851 5.24208 14.0871 10.111 9.47945 9.12839 6.51523 9.67711 12.6471 numMergedOcc 0
7 mol 226 unq 0 iso 0 dist 9.37229 7.54614 6.92911 9.97507 8.10096 7.20862 10.2945 14.8729 8.31266 13.7904 numMergedOcc 0
8 mol 258 unq 0 iso 0 dist 8.37512 9.52903 11.3847 13.2258 16.651 6.08181 11.7204 18.0482 9.6327 6.49094 numMergedOcc 0
9 mol 258 unq 1 iso 0 dist 8.37512 9.52903 11.3847 3.95075 10.6148 7.70189 11.7204 18.0482 9.6327 8.08023 numMergedOcc 0
10 mol 259 unq 0 iso 0 dist 7.34794 8.06908 6.92619 7.10624 7.97113 8.91916 5.49348 4.95855 8.40328 10.2743 numMergedOcc 0
11 mol 259 unq 1 iso 0 dist 7.34794 8.06908 6.92619 7.10624 7.97113 8.91916 5.13138 7.72489 8.2518 11.46 numMergedOcc 0
12 mol 259 unq 2 iso 0 dist 7.34794 8.06908 6.92619 5.09929 5.22111 4.55368 5.49348 4.95855 8.40328 7.06301 numMergedOcc 0
13 mol 259 unq 3 iso 0 dist 7.34794 8.06908 6.92619 5.09929 5.22111 4.55368 5.13138 7.72489 8.2518 7.80863 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 9.39409 6.76192 5.66584 4.157 12.4464 8.0935 5.64662 9.27722 7.19568 7.23485 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 9.39409 6.76192 5.66584 4.157 12.4464 8.0935 5.64662 9.27722 7.19568 7.23485 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 9.39409 6.76192 5.66584 4.157 12.4464 8.0935 5.64662 9.27722 7.19568 7.23485 numMergedOcc 0
