0 mol 10 unq 0 iso 0 dist 9.56259 5.06897 10.1818 9.0507 17.9407 9.38807 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.56259 5.06897 10.1818 7.06047 16.3815 9.17211 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 7.71544 9.44958 10.8881 14.2898 17.416 7.98679 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.59503 8.95651 7.34488 4.1125 7.7913 9.05259 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 9.61119 8.95651 6.3035 4.1125 10.8438 9.05259 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 8.43293 9.27951 4.63594 6.71699 8.73484 6.03352 numMergedOcc 0
6 mol 163 unq 0 iso 0 dist 7.7264 9.3832 15.0568 4.04072 7.81715 9.79069 numMergedOcc 0
7 mol 163 unq 1 iso 0 dist 7.7264 9.3832 15.0568 16.9342 22.1176 9.27496 numMergedOcc 0
8 mol 163 unq 2 iso 0 dist 7.5447 6.0247 3.64474 12.5525 13.1944 9.79069 numMergedOcc 0
9 mol 163 unq 3 iso 0 dist 7.5447 6.0247 3.64474 4.37572 9.86052 9.27496 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 8.59783 7.68295 5.31547 4.98945 6.21194 8.1536 numMergedOcc 0
11 mol 237 unq 0 iso 0 dist 9.18638 9.80232 12.7987 11.5107 17.2533 6.11495 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 5.86679 5.66593 4.2759 5.40441 8.55613 7.44706 numMergedOcc 0
13 mol 243 unq 1 iso 0 dist 8.28347 5.66593 5.81296 5.40441 12.3886 7.44706 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.64278 8.78354 5.67781 4.17741 9.58735 9.91199 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 6.15713 8.78354 4.88527 4.17741 8.12414 9.91199 numMergedOcc 0
16 mol 286 unq 0 iso 0 dist 5.03123 7.3415 6.77784 5.38595 9.82413 8.69826 numMergedOcc 0
