0 mol 0 unq 0 iso 0 dist 9.42137 7.31837 5.24778 3.68241 11.8368 9.00092 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.7522 8.99751 10.797 13.4787 16.1166 9.36924 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.7522 9.44507 10.9837 8.43529 13.6545 6.7142 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.36193 5.84625 9.95364 7.4999 13.813 7.58739 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.36193 5.84625 9.95364 4.99692 9.22598 9.01564 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 6.36193 5.84625 9.95364 3.70586 9.55996 7.11065 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 4.88613 5.84625 5.49591 7.4999 11.2189 7.58739 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 4.88613 5.84625 5.49591 4.99692 8.96727 9.01564 numMergedOcc 0
8 mol 58 unq 5 iso 0 dist 4.88613 5.84625 5.49591 3.70586 8.01308 7.11065 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 8.86252 5.51406 9.13283 6.44712 14.2504 8.77355 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 5.17585 8.23777 5.76098 3.82552 4.22363 5.36587 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 7.53905 5.42828 5.76986 3.61827 9.05166 8.72725 numMergedOcc 0
12 mol 112 unq 2 iso 0 dist 7.53905 5.42828 5.76986 3.78964 5.56994 6.11407 numMergedOcc 0
13 mol 112 unq 3 iso 0 dist 7.15985 5.42828 5.39346 3.61827 10.2348 8.72725 numMergedOcc 0
14 mol 112 unq 4 iso 0 dist 7.15985 5.42828 5.39346 3.78964 9.95699 6.11407 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 8.82535 9.34823 6.09547 5.92411 11.0072 8.67537 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 6.18763 9.34823 5.13589 5.92411 8.95212 8.67537 numMergedOcc 0
17 mol 119 unq 2 iso 0 dist 8.44385 9.34823 10.8661 5.92411 6.99446 8.67537 numMergedOcc 0
18 mol 119 unq 3 iso 0 dist 5.63005 9.34823 12.0175 5.92411 7.64052 8.67537 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 9.50322 6.72323 12.538 11.5628 12.5855 8.83732 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 5.82404 6.72323 4.54648 11.5628 8.77023 8.83732 numMergedOcc 0
21 mol 154 unq 0 iso 0 dist 6.23399 5.60184 7.51976 5.18463 8.33439 8.71789 numMergedOcc 0
22 mol 154 unq 1 iso 0 dist 6.23399 7.08477 7.23684 5.18463 8.33439 5.2693 numMergedOcc 0
23 mol 206 unq 0 iso 0 dist 9.78438 8.15381 11.7977 6.98142 13.9709 8.24419 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 7.85877 5.89818 7.75656 4.91709 5.56538 8.43195 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 7.85877 5.89818 7.75656 5.96186 7.48954 8.23406 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 7.70279 7.83422 12.3508 6.54593 11.4909 6.59036 numMergedOcc 0
27 mol 232 unq 1 iso 0 dist 9.29752 7.83422 8.80479 6.54593 10.3021 6.59036 numMergedOcc 0
28 mol 236 unq 0 iso 0 dist 6.11137 8.37813 9.52712 5.45156 10.0129 6.15635 numMergedOcc 0
29 mol 236 unq 1 iso 0 dist 7.89744 8.37813 14.1812 5.45156 13.2757 6.15635 numMergedOcc 0
30 mol 267 unq 0 iso 0 dist 9.62043 9.80577 8.37094 8.3484 7.34981 6.27154 numMergedOcc 0
