0 mol 9 unq 0 iso 0 dist 6.51397 8.79695 4.84673 9.99657 6.96891 11.0672 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.51397 5.2505 7.18286 9.99657 6.96891 11.7447 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 8.86252 8.6176 7.03963 5.51406 9.13283 6.59567 numMergedOcc 0
3 mol 108 unq 0 iso 0 dist 8.77983 9.87572 7.21429 9.39566 4.53977 4.74403 numMergedOcc 0
4 mol 108 unq 1 iso 0 dist 8.77983 7.05541 4.11354 9.39566 4.53977 6.507 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 5.17585 8.12196 6.68847 8.23777 5.76098 8.7368 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.91337 8.04669 12.378 8.4733 5.92984 14.6891 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 7.91337 7.46162 12.5595 8.4733 5.92984 11.7528 numMergedOcc 0
8 mol 119 unq 2 iso 0 dist 6.40546 8.04669 8.87718 8.4733 7.45148 14.6891 numMergedOcc 0
9 mol 119 unq 3 iso 0 dist 6.40546 7.46162 4.72999 8.4733 7.45148 11.7528 numMergedOcc 0
10 mol 119 unq 4 iso 0 dist 8.82535 6.29634 7.64945 9.34823 6.09547 6.65893 numMergedOcc 0
11 mol 119 unq 5 iso 0 dist 6.18763 6.29634 7.36889 9.34823 5.13589 6.65893 numMergedOcc 0
12 mol 119 unq 6 iso 0 dist 8.44385 6.29634 4.55137 9.34823 10.8661 6.65893 numMergedOcc 0
13 mol 119 unq 7 iso 0 dist 5.63005 6.29634 6.42493 9.34823 12.0175 6.65893 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 9.50322 6.31523 10.7358 6.72323 12.538 5.21958 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 5.82404 6.31523 5.58281 6.72323 4.54648 5.21958 numMergedOcc 0
16 mol 157 unq 0 iso 0 dist 6.1835 6.09357 3.8758 9.30128 8.0238 11.3794 numMergedOcc 0
17 mol 157 unq 1 iso 0 dist 6.1835 6.09357 3.8758 9.04487 6.41986 9.68192 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 9.97921 8.99034 5.05715 8.63323 6.07158 6.76865 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 9.46833 7.43598 12.6178 7.91434 4.62636 9.03053 numMergedOcc 0
20 mol 169 unq 1 iso 0 dist 9.46833 7.43598 12.6178 7.79437 5.81985 12.4425 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 8.58906 9.52193 3.98983 7.42278 7.68909 11.1853 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 9.78438 6.38964 6.13816 8.15381 11.7977 6.97126 numMergedOcc 0
23 mol 257 unq 0 iso 0 dist 9.83721 9.91856 8.55247 8.4302 5.754 9.83768 numMergedOcc 0
