0 mol 7 unq 0 iso 0 dist 7.38748 7.15287 6.8464 6.22892 5.0893 8.41585 15.5737 12.1991 14.7759 9.68596 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.85737 6.88453 8.0319 13.0211 11.4109 6.86014 10.5906 13.1713 6.66749 9.41441 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 8.8795 10.0338 8.44473 16.1999 11.2947 6.65721 22.2651 18.6888 13.5488 9.25641 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.52643 15.4665 8.75668 15.3102 7.26966 9.67592 12.0216 5.94373 6.21578 9.97159 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 5.41357 9.95527 8.75668 12.3873 7.26966 9.67592 7.07433 5.94373 6.21578 9.97159 numMergedOcc 0
5 mol 75 unq 0 iso 0 dist 8.25597 5.56574 9.20448 13.0751 14.2474 7.79912 15.7956 20.477 11.4997 9.81166 numMergedOcc 0
6 mol 75 unq 1 iso 0 dist 4.76466 5.56574 6.96759 13.0751 13.8905 7.79912 15.7956 18.043 11.4997 9.81166 numMergedOcc 0
7 mol 75 unq 2 iso 0 dist 8.67172 5.56574 6.97318 13.0751 11.2774 7.79912 15.7956 17.0121 11.4997 9.81166 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.52061 5.99695 8.59695 10.482 6.13737 5.83384 5.9261 6.52844 4.55551 6.28565 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 9.52061 5.99695 8.59695 10.482 6.13737 5.83384 13.835 9.47532 10.5488 7.58957 numMergedOcc 0
10 mol 129 unq 2 iso 0 dist 9.61101 6.29782 6.42706 10.514 5.12351 5.83384 8.05783 9.51709 4.55551 6.28565 numMergedOcc 0
11 mol 129 unq 3 iso 0 dist 9.61101 6.29782 6.42706 10.514 5.12351 5.83384 11.9282 11.1555 10.5488 7.58957 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.8353 17.2988 9.47554 10.614 5.34829 7.11802 6.14377 10.1132 16.0138 9.22232 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 8.8353 17.2988 9.47554 10.614 5.34829 7.11802 17.9771 10.7163 5.92062 9.22661 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 8.8353 17.2988 9.47554 10.614 5.34829 7.11802 17.4471 12.2027 6.61891 7.56378 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 9.52029 18.5654 9.44947 17.8571 10.2677 8.51516 16.9386 7.59757 5.86489 7.32294 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 5.25149 6.19375 5.39218 15.0279 13.3213 9.23153 10.7876 10.6444 7.11498 6.59716 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.46734 6.03322 6.43546 11.9377 5.54495 7.00034 11.7623 8.99878 10.0842 9.01021 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 8.10903 9.78068 9.04358 14.0712 8.81588 6.60405 15.1358 13.3737 5.63675 7.21311 numMergedOcc 0
