0 mol 24 unq 0 iso 0 dist 4.93188 8.70827 9.75636 8.23075 4.21283 12.2271 5.11617 4.90592 12.8389 7.85986 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 4.93188 8.70827 9.75636 8.23075 4.21283 12.2271 10.8238 8.16324 11.6684 11.0098 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 4.93188 8.70827 9.75636 4.7841 4.97191 12.6431 5.11617 4.90592 12.8389 4.30252 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 4.93188 8.70827 9.75636 4.7841 4.97191 12.6431 10.8238 8.16324 11.6684 12.496 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 4.93188 6.73939 10.0715 8.23075 4.21283 12.2839 5.11617 4.90592 6.72323 7.85986 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 4.93188 6.73939 10.0715 8.23075 4.21283 12.2839 10.8238 8.16324 15.7523 11.0098 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 4.93188 6.73939 10.0715 4.7841 4.97191 6.22954 5.11617 4.90592 6.72323 4.30252 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 4.93188 6.73939 10.0715 4.7841 4.97191 6.22954 10.8238 8.16324 15.7523 12.496 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.26086 6.65501 11.2092 7.92856 8.67903 11.6496 7.06961 8.43352 6.88901 13.6994 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.34525 6.84011 8.51024 9.93438 13.7162 5.99273 12.7083 9.35942 14.1286 19.774 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 7.99623 8.99399 4.99495 7.60162 8.90156 5.77063 7.45148 9.9151 7.20249 6.21165 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 9.29384 8.70296 10.8127 8.80895 9.6795 5.92118 13.1439 5.44303 15.6807 15.122 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 9.29384 8.70296 10.8127 8.80895 9.6795 5.92118 13.7237 8.50562 18.6956 17.1537 numMergedOcc 0
13 mol 131 unq 2 iso 0 dist 9.29384 9.25558 11.2516 8.80895 9.6795 10.2176 13.1439 5.44303 14.8175 15.122 numMergedOcc 0
14 mol 131 unq 3 iso 0 dist 9.29384 9.25558 11.2516 8.80895 9.6795 10.2176 13.7237 8.50562 13.2952 17.1537 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 7.35824 9.39352 10.3786 9.19156 14.7729 11.8094 11.8693 5.89564 16.2138 19.542 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 7.35824 9.39352 10.3786 9.19156 14.7729 11.8094 6.77832 5.60528 13.4698 15.721 numMergedOcc 0
17 mol 175 unq 2 iso 0 dist 9.17364 9.39352 11.9672 9.19156 18.0583 11.8094 6.77832 5.5995 13.4698 15.721 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 6.26839 8.65535 5.92931 9.52922 7.82899 3.7326 11.6598 5.68348 6.1886 8.13022 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 5.60393 5.44002 8.46033 7.13783 12.0319 4.76454 14.4523 9.17946 17.31 21.128 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 7.83711 9.05071 13.8622 8.25985 6.20756 12.159 4.9377 6.57921 9.8664 9.78273 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 7.83711 9.05071 13.8622 9.27788 11.7554 8.36223 4.9377 6.57921 9.8664 11.9664 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 9.56685 9.85289 5.36428 9.83622 8.10746 5.14522 5.29529 8.2997 6.88827 9.2199 numMergedOcc 0
