0 mol 54 unq 0 iso 0 dist 4.38047 6.76462 6.14538 5.97635 4.29856 6.83299 6.31564 8.77224 10.3564 6.59893 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 4.38047 6.76462 6.14538 5.97635 4.29856 6.83299 4.94741 5.7405 10.4238 5.59773 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.84625 5.40367 8.80614 6.36193 9.95364 6.62496 7.63046 11.799 11.5882 7.84983 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 5.84625 5.40367 8.80614 4.88613 5.49591 6.35756 7.63046 11.799 11.5882 9.56737 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 6.94677 8.42799 9.25641 14.5113 13.5488 6.65721 16.5472 19.3555 10.7369 9.62468 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 6.94677 8.42799 9.25641 14.5113 13.5488 6.65721 10.6807 11.9267 5.4671 5.92705 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.18898 4.52119 6.95572 11.8917 9.50382 7.4729 14.8919 7.44343 11.8037 9.514 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 7.67331 4.52119 7.38677 11.8917 12.7565 7.4729 14.8919 13.7462 11.8037 9.514 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.34823 5.3154 6.73586 6.18763 5.13589 6.18601 4.46648 10.0649 5.19198 6.49205 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 8.97111 4.84035 6.30546 8.32241 6.0268 6.06638 9.63225 12.4696 7.01529 9.54928 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 8.6561 7.36833 6.66772 13.1045 7.12976 6.5107 14.4108 13.4486 8.00493 8.84018 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 8.6561 5.27217 7.71248 13.2491 10.6025 8.22656 20.6664 19.1869 15.4455 9.4473 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 7.4513 8.0303 6.59716 10.6535 7.11498 9.23153 17.8482 12.6669 14.6296 7.31105 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 8.63176 6.48867 7.21311 5.73834 5.63675 6.60405 3.95075 12.1556 10.221 8.58088 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 9.3201 3.93713 7.16853 8.19504 5.00209 6.24356 9.00704 9.14393 10.0289 6.75305 numMergedOcc 0
