0 mol 26 unq 0 iso 0 dist 9.19362 7.46207 10.3363 7.35595 9.10253 8.82012 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 8.85697 6.32012 9.22921 5.19805 7.61402 6.99408 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.65026 9.70415 7.15161 10.4362 13.6867 8.76003 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.24753 8.41567 5.49132 7.5192 6.22513 6.21982 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.24753 5.56964 6.71804 11.2136 8.35595 8.97793 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 8.24753 5.56964 6.71804 7.5192 6.22513 8.19682 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 9.07645 7.23973 5.5076 5.27409 10.521 7.12609 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 8.59587 9.62866 10.2964 11.5609 13.547 6.73814 numMergedOcc 0
8 mol 114 unq 2 iso 0 dist 8.59587 7.23973 8.6358 5.27409 11.6889 7.12609 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 9.14994 7.0318 5.34484 5.70073 11.3437 6.62561 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.83602 8.88255 5.44942 10.06 10.9472 9.63176 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 7.55428 8.88255 4.6251 10.06 12.5653 9.63176 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 9.12773 8.99949 5.29825 9.45501 10.1792 6.91348 numMergedOcc 0
13 mol 131 unq 1 iso 0 dist 9.12773 8.99949 5.29825 9.03202 13.4104 9.51418 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.33909 7.34465 10.9623 11.9359 17.5 6.93652 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 8.7192 7.98018 7.90642 4.71629 11.9574 7.55203 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 9.18725 8.3705 6.94759 12.124 13.8389 8.36117 numMergedOcc 0
17 mol 195 unq 1 iso 0 dist 9.18725 8.3705 6.94759 6.91511 10.8235 6.77578 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 9.86427 8.98668 10.0597 13.6264 13.444 6.83797 numMergedOcc 0
