0 mol 43 unq 0 iso 0 dist 8.38387 11.0096 8.80331 11.8286 6.20293 8.13395 18.6421 14.0634 9.89546 14.792 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.38387 11.8286 6.20293 11.0096 8.80331 8.13395 9.52295 6.09486 9.07906 14.1869 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.97635 10.7219 9.5589 6.76462 6.83299 5.08001 14.4034 15.2053 8.41018 11.78 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 5.97635 10.7219 9.5589 13.2619 8.10861 16.3192 14.4034 15.2053 8.41018 22.4204 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.65047 5.33325 7.27724 5.69671 8.03644 8.41707 11.1742 14.2706 8.69749 16.0612 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 9.65047 5.33325 7.27724 5.69671 8.03644 8.41707 10.154 11.0946 5.96576 14.145 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 8.73648 9.47324 7.34473 4.93112 8.58044 7 14.5487 6.62208 8.43667 13.4519 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 8.73648 9.47324 7.34473 4.48038 9.97763 8.40993 14.5487 6.62208 8.43667 14.2582 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 7.04864 6.81949 6.44653 4.5543 8.75408 5.23036 11.6385 4.98499 8.1671 12.259 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 5.82404 4.64588 6.80239 10.2385 6.29155 7.81217 6.31523 5.58281 8.75049 10.6168 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 5.82404 4.64588 6.80239 5.37072 8.00618 7.79672 6.31523 5.58281 8.75049 10.6275 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 8.07256 11.1874 6.70283 10.4039 8.56324 7.65448 9.06801 5.97115 8.86966 13.4958 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 8.07256 11.1874 6.70283 8.36099 7.16148 5.49936 9.06801 5.97115 8.86966 5.7527 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 8.07256 8.36099 7.16148 10.4039 8.56324 10.6875 9.06801 5.97115 5.7527 13.4958 numMergedOcc 0
14 mol 152 unq 3 iso 0 dist 8.07256 8.36099 7.16148 11.1874 6.70283 5.49936 9.06801 5.97115 5.7527 8.86966 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 9.90531 8.43102 5.59424 4.96445 7.00794 5.76246 16.5043 10.375 8.63044 14.2991 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 6.37672 4.24014 6.18582 9.07501 7.57994 5.01979 5.68936 5.40456 7.27415 10.3622 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 8.94023 5.36989 6.18582 9.53929 7.57994 5.01979 9.92463 5.40456 7.27415 10.3622 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 8.43858 8.55312 6.24356 10.2215 9.361 10.3202 14.869 14.5632 8.48407 15.0114 numMergedOcc 0
