0 mol 4 unq 0 iso 0 dist 7.72767 7.29958 7.09907 11.7001 4.47629 9.0984 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.19078 7.33499 8.98177 9.71933 4.95968 9.03346 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.2044 4.19866 9.98353 12.4652 11.8315 8.79378 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.56621 3.95228 6.88786 6.82511 5.37935 5.57551 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.83159 8.97165 8.71103 11.608 8.14479 7.06029 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.19523 5.76592 6.59382 10.3808 7.41773 6.04223 numMergedOcc 0
6 mol 101 unq 0 iso 0 dist 5.58941 4.58154 5.5199 8.8847 4.19577 6.67863 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 5.98822 4.36058 6.81489 4.60192 5.11935 6.01857 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 9.79589 4.9142 9.12964 12.692 7.47617 9.18784 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 9.66306 3.55317 9.12964 6.84006 7.47617 9.18784 numMergedOcc 0
10 mol 120 unq 2 iso 0 dist 8.84182 4.53716 9.12964 9.08322 7.47617 9.18784 numMergedOcc 0
11 mol 136 unq 0 iso 0 dist 9.73117 4.90618 9.87222 12.7412 9.72078 9.73897 numMergedOcc 0
12 mol 136 unq 1 iso 0 dist 9.73117 4.90618 9.87222 6.99374 4.91049 8.59512 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 8.93408 11.2108 6.00651 11.9707 6.99467 8.76449 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 8.93408 11.2108 6.00651 11.4766 4.53687 8.36182 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.58272 4.81196 7.31277 11.8147 4.8443 8.26128 numMergedOcc 0
16 mol 154 unq 1 iso 0 dist 5.67578 7.0408 7.31277 5.55632 4.8443 8.26128 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.55517 13.7072 9.71223 12.107 5.56574 6.99587 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 9.55517 13.7072 9.71223 12.9882 7.76011 4.37577 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 7.38809 4.69185 6.11539 10.4181 3.79439 8.54126 numMergedOcc 0
20 mol 232 unq 1 iso 0 dist 7.38809 12.5532 9.71082 18.9794 13.4178 9.33969 numMergedOcc 0
21 mol 232 unq 2 iso 0 dist 7.38809 12.5532 9.71082 10.4181 3.79439 7.64079 numMergedOcc 0
22 mol 269 unq 0 iso 0 dist 6.33404 10.7788 7.97206 6.8127 4.41005 6.72096 numMergedOcc 0
23 mol 269 unq 1 iso 0 dist 6.33404 5.39605 7.1068 6.8127 4.41005 9.18157 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 8.54272 11.9766 8.26851 13.5011 13.8247 9.82713 numMergedOcc 0
25 mol 274 unq 1 iso 0 dist 9.43429 11.9766 8.14634 13.5011 9.90818 9.82713 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 7.64578 5.90162 9.86356 6.82335 10.2032 9.64969 numMergedOcc 0
27 mol 294 unq 1 iso 0 dist 5.85292 8.68297 9.86356 9.14005 10.2032 9.64969 numMergedOcc 0
28 mol 294 unq 2 iso 0 dist 6.28096 5.90162 6.42303 6.82335 5.33113 9.64969 numMergedOcc 0
29 mol 294 unq 3 iso 0 dist 6.20852 4.10727 5.27236 10.1507 4.99494 7.48987 numMergedOcc 0
30 mol 294 unq 4 iso 0 dist 6.20852 4.10727 5.27236 10.9299 9.15036 8.35637 numMergedOcc 0
