0 mol 11 unq 0 iso 0 dist 5.96346 8.68293 13.5125 10.7734 7.98326 18.8128 10.0658 8.17605 18.4104 9.09091 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.96346 6.84216 6.76736 10.7734 7.98326 9.81983 10.0658 8.17605 3.66215 9.09091 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 6.35398 8.01262 12.9584 10.9183 7.98326 18.6918 9.53002 7.5901 16.7805 8.73067 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 6.35398 6.58046 6.51674 10.9183 7.98326 10.0282 9.53002 7.5901 3.56133 8.73067 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 5.89412 8.4014 5.69755 9.75966 6.03257 11.1524 9.29358 6.19131 11.1793 6.50647 numMergedOcc 0
5 mol 17 unq 0 iso 0 dist 9.78331 8.70792 6.43075 5.67637 7.25951 10.1852 10.0032 6.31299 8.91991 7.82406 numMergedOcc 0
6 mol 17 unq 1 iso 0 dist 9.78331 8.70792 6.43075 4.03817 7.92012 5.16502 10.0032 6.31299 8.91991 9.877 numMergedOcc 0
7 mol 19 unq 0 iso 0 dist 6.41423 7.7312 5.31883 7.08342 9.95212 12.7679 8.58657 5.90856 9.61438 7.02548 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 6.65501 7.92856 11.6496 7.06961 6.88901 13.6994 10.417 5.71029 16.7408 6.0129 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.99399 7.60162 5.77063 7.45148 7.20249 6.21165 10.5042 4.48922 3.71283 7.26955 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 6.22122 9.70481 13.4378 13.0409 8.86197 18.6281 13.1996 7.23063 19.9421 6.32777 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 8.65535 9.52922 3.7326 11.6598 6.1886 8.13022 12.1599 11.8663 14.7839 8.52969 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 9.05071 8.25985 12.159 4.9377 9.8664 9.78273 11.4727 16.1253 12.899 7.17337 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 9.05071 9.27788 8.36223 4.9377 9.8664 11.9664 11.4727 16.1253 17.2552 7.17337 numMergedOcc 0
14 mol 237 unq 0 iso 0 dist 9.20822 9.7255 12.5736 10.6582 8.10254 12.0818 10.9067 9.55218 5.11578 9.27395 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 8.94014 8.94231 13.4894 5.50308 5.92374 9.78013 10.6978 4.38002 12.0336 6.62002 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 8.94014 8.94231 13.4894 5.50308 5.92374 9.78013 11.1159 14.6816 6.04327 9.69818 numMergedOcc 0
17 mol 238 unq 2 iso 0 dist 8.94014 8.94231 13.4894 5.50308 5.92374 9.78013 6.05141 11.5793 3.94343 6.73446 numMergedOcc 0
18 mol 238 unq 3 iso 0 dist 7.02333 8.88652 13.4894 7.11984 5.92374 9.78013 8.14172 4.38002 12.0336 6.62002 numMergedOcc 0
19 mol 238 unq 4 iso 0 dist 7.02333 8.88652 13.4894 7.11984 5.92374 9.78013 12.7101 14.6816 6.04327 9.69818 numMergedOcc 0
20 mol 238 unq 5 iso 0 dist 7.02333 8.88652 13.4894 7.11984 5.92374 9.78013 8.09066 11.5793 3.94343 6.73446 numMergedOcc 0
21 mol 238 unq 6 iso 0 dist 8.67864 6.46771 13.4894 7.95232 5.92374 9.78013 6.77463 4.38002 12.0336 6.62002 numMergedOcc 0
22 mol 238 unq 7 iso 0 dist 8.67864 6.46771 13.4894 7.95232 5.92374 9.78013 9.93432 14.6816 6.04327 9.69818 numMergedOcc 0
23 mol 238 unq 8 iso 0 dist 8.67864 6.46771 13.4894 7.95232 5.92374 9.78013 7.2766 11.5793 3.94343 6.73446 numMergedOcc 0
