0 mol 34 unq 0 iso 0 dist 9.18109 5.66535 6.87871 5.80438 6.40741 8.04976 7.36836 15.1968 9.99939 12.9209 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.18109 5.66535 6.87871 4.49056 9.31366 9.01679 7.36836 15.1968 9.99939 10.006 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 9.94799 15.3073 9.23576 5.01416 9.18985 11.3707 16.3808 7.10133 8.83233 14.4983 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 5.28955 10.7421 9.93703 4.09788 6.13508 7.45148 9.72764 8.99475 7.60162 6.21165 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 6.85651 4.84607 8.84018 14.4497 8.70392 17.168 4.82356 3.75786 5.78814 12.4466 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 7.03858 11.981 8.84018 9.26708 8.70392 17.168 8.83476 3.75786 5.78814 12.4466 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 6.00651 6.91778 9.18866 7.38323 5.08863 8.93262 8.76449 6.99467 6.73617 9.59327 numMergedOcc 0
7 mol 147 unq 1 iso 0 dist 6.00651 6.91778 9.18866 7.38323 5.08863 8.93262 8.36182 4.53687 9.03544 8.51399 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 9.51731 6.46702 9.82249 7.15755 8.62413 4.20425 9.067 3.57652 7.93088 5.67088 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 9.92635 10.0008 7.31181 8.96895 5.5781 6.59099 7.16035 10.7786 9.96536 12.6071 numMergedOcc 0
10 mol 183 unq 1 iso 0 dist 7.85507 9.95614 7.31181 6.57004 5.5781 6.59099 9.61725 10.7786 9.96536 12.6071 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 6.09754 4.78067 8.43584 8.35349 6.05667 11.6232 13.0087 14.8213 9.31158 19.8707 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 6.11539 5.70808 8.68464 9.74489 6.67239 14.3553 8.54126 3.79439 8.60731 9.89191 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 6.11539 5.70808 8.68464 6.70882 6.23146 11.776 8.54126 3.79439 8.60731 9.83281 numMergedOcc 0
14 mol 232 unq 2 iso 0 dist 9.71082 4.86949 8.68464 16.2642 6.67239 14.3553 7.64079 3.79439 8.60731 9.89191 numMergedOcc 0
15 mol 232 unq 3 iso 0 dist 9.71082 4.86949 8.68464 14.3107 6.23146 11.776 7.64079 3.79439 8.60731 9.83281 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 6.98812 5.58514 9.59213 10.7881 7.49913 13.9888 12.6665 13.876 8.54108 20.2931 numMergedOcc 0
17 mol 294 unq 0 iso 0 dist 5.27236 5.57606 6.47832 7.33654 6.1268 5.42688 7.48987 4.99494 7.56669 9.93413 numMergedOcc 0
