0 mol 8 unq 0 iso 0 dist 6.68091 7.91052 6.04779 12.7755 9.00925 14.4873 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 4.62913 8.99098 8.5421 7.18195 5.9021 14.2972 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 4.62913 8.99098 8.5421 6.70723 8.98466 7.96154 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 7.96306 7.88321 12.0861 12.6215 7.55357 18.4589 numMergedOcc 0
4 mol 38 unq 1 iso 0 dist 7.96306 7.88321 12.0861 5.47531 5.86972 12.3704 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.35789 8.58588 8.89127 7.63029 7.61631 15.0443 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 9.00405 9.62387 18.3118 6.73658 7.09393 15.7537 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 9.00405 9.62387 18.3118 6.55166 3.87167 15.973 numMergedOcc 0
8 mol 69 unq 2 iso 0 dist 9.00405 9.62336 10.3416 6.73658 7.09393 13.7519 numMergedOcc 0
9 mol 69 unq 3 iso 0 dist 9.00405 9.62336 10.3416 6.55166 3.87167 11.6234 numMergedOcc 0
10 mol 99 unq 0 iso 0 dist 8.44207 7.09617 8.61334 6.9006 6.81741 8.23566 numMergedOcc 0
11 mol 163 unq 0 iso 0 dist 8.66172 6.96837 10.5262 10.2273 9.85967 16.3375 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 7.7013 9.51041 13.6249 14.2738 8.6609 17.6333 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 7.7013 9.51041 13.6249 8.62822 6.21546 14.3793 numMergedOcc 0
14 mol 175 unq 2 iso 0 dist 7.7013 9.51041 13.6249 7.44933 6.03184 16.3925 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 9.53211 9.16789 8.64762 13.7123 6.51428 13.0526 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.17911 5.53473 11.1086 5.62491 6.08181 9.26487 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 9.17911 5.53473 11.1086 15.136 7.70189 17.4434 numMergedOcc 0
18 mol 258 unq 2 iso 0 dist 9.52903 6.41167 5.79358 13.2258 6.08181 10.9114 numMergedOcc 0
19 mol 258 unq 3 iso 0 dist 9.52903 6.41167 5.79358 3.95075 7.70189 6.59521 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 7.66705 4.88541 5.08317 4.90213 5.28417 6.35457 numMergedOcc 0
21 mol 271 unq 0 iso 0 dist 9.80493 8.54162 12.5349 13.1235 8.07242 17.7366 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 6.28023 7.03782 9.24343 5.66978 6.12202 5.59151 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 9.5388 6.64892 8.78819 16.342 9.68846 16.5379 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 6.39586 7.35799 6.25345 6.68556 7.2783 12.2322 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 9.56601 8.8643 4.77763 6.17316 5.78017 8.36655 numMergedOcc 0
26 mol 279 unq 2 iso 0 dist 9.56601 8.8643 4.77763 13.1019 8.78203 10.6842 numMergedOcc 0
27 mol 279 unq 3 iso 0 dist 6.70261 8.8643 5.44699 6.00582 7.319 10.0305 numMergedOcc 0
28 mol 279 unq 4 iso 0 dist 6.70261 8.8643 5.44699 6.17316 6.12742 8.36655 numMergedOcc 0
29 mol 279 unq 5 iso 0 dist 6.70261 8.8643 5.44699 8.96297 9.45886 13.376 numMergedOcc 0
30 mol 280 unq 0 iso 0 dist 7.78355 4.26671 6.12141 10.0698 6.83927 9.047 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 8.55037 6.33332 10.8016 7.77878 8.0661 13.6269 numMergedOcc 0
