0 mol 16 unq 0 iso 0 dist 9.04834 8.17898 10.2656 6.05535 4.7319 11.0958 5.36911 6.51133 5.30082 6.72833 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.17898 9.04834 10.2656 5.72175 5.05803 11.6856 5.36911 5.30082 6.51133 6.93532 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.84393 7.78708 8.01051 9.01721 7.82074 14.2684 10.7145 6.01808 12.6304 6.41575 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 5.87895 9.57974 4.87334 5.75653 7.36323 11.5038 14.0475 13.2229 16.4442 8.4051 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 5.87895 9.57974 4.87334 5.75653 7.36323 11.5038 7.06532 6.38336 6.51 8.23446 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 5.87895 9.57974 4.87334 5.75653 7.36323 11.5038 11.0714 6.7828 9.54582 8.75662 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 9.10915 7.02352 9.21892 9.73304 9.67592 13.3406 12.219 6.21578 10.0817 9.97159 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 6.30194 4.24428 5.7113 10.5627 6.19304 11.4799 10.9561 6.56633 8.44406 9.24757 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 8.35604 8.93552 10.2788 5.3967 5.11551 11.2489 11.0607 6.77806 16.4414 6.92026 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 8.35604 8.93552 10.2788 11.9798 7.11972 16.1842 11.0607 6.77806 16.4414 5.88249 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 7.83568 6.20658 10.2788 7.10772 5.11551 11.2489 13.3321 6.77806 16.4414 6.92026 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 7.83568 6.20658 10.2788 11.3906 7.11972 16.1842 13.3321 6.77806 16.4414 5.88249 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 5.67862 7.97208 5.00817 9.52819 6.37586 6.49416 10.8422 5.29786 5.71679 6.23142 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 5.67862 7.97208 5.00817 12.4156 9.71307 12.5075 10.8422 5.29786 5.71679 9.94764 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 7.97208 5.67862 5.00817 12.5576 6.54501 9.5126 10.8422 5.71679 5.29786 7.69991 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 7.97208 5.67862 5.00817 9.52819 6.49416 6.37586 10.8422 5.71679 5.29786 6.23142 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 7.7292 6.27396 12.5143 9.54287 8.51516 13.8351 8.82861 5.86489 11.2903 7.32294 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 7.98022 8.89538 13.0839 6.3873 5.72887 10.3007 12.3944 14.7883 10.4017 9.24557 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 7.15785 9.43169 5.51688 6.5875 8.02547 6.05727 11.3138 5.91643 5.02383 8.43974 numMergedOcc 0
19 mol 261 unq 1 iso 0 dist 9.43169 7.15785 5.51688 6.5875 6.05727 8.02547 11.3138 5.02383 5.91643 8.43974 numMergedOcc 0
20 mol 282 unq 0 iso 0 dist 6.84554 9.51581 4.66602 9.67023 8.76532 6.33524 14.0832 8.12478 5.0324 9.0975 numMergedOcc 0
21 mol 282 unq 1 iso 0 dist 9.51581 6.84554 4.66602 9.67023 6.33524 8.76532 14.0832 5.0324 8.12478 9.0975 numMergedOcc 0
