0 mol 10 unq 0 iso 0 dist 9.39017 5.8369 11.9147 4.71606 13.1846 9.17574 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.39017 5.8369 11.9147 8.74239 17.8292 8.79953 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 8.23202 8.38624 6.64571 5.74722 8.0543 9.42876 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.50475 9.55284 3.50984 12.3426 8.29857 5.7836 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 7.66163 7.36877 3.50984 11.2238 8.29857 5.7836 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 8.82709 7.90416 7.06935 11.0942 11.114 9.42099 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 8.82709 9.74553 10.6648 5.84184 11.5516 5.72703 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 7.1796 6.89752 3.65036 11.0606 8.19993 5.82264 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 7.1796 6.89752 3.65036 8.31475 11.427 8.56365 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 7.1796 6.85843 5.37655 8.31475 11.427 8.74151 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 9.16212 7.94814 5.37655 12.4972 11.427 8.74151 numMergedOcc 0
11 mol 48 unq 8 iso 0 dist 9.16212 9.55632 8.48119 12.4972 11.427 8.69662 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 5.72627 6.64921 4.37918 4.39227 8.03296 8.84225 numMergedOcc 0
13 mol 79 unq 1 iso 0 dist 5.72627 6.64921 4.37918 8.32896 9.26979 6.72546 numMergedOcc 0
14 mol 79 unq 2 iso 0 dist 7.68741 6.64921 9.08423 4.39227 5.82754 8.84225 numMergedOcc 0
15 mol 79 unq 3 iso 0 dist 7.68741 6.64921 9.08423 8.32896 9.05679 6.72546 numMergedOcc 0
16 mol 79 unq 4 iso 0 dist 9.86085 6.64921 11.2822 4.39227 10.0459 8.84225 numMergedOcc 0
17 mol 79 unq 5 iso 0 dist 9.86085 6.64921 11.2822 8.32896 13.9817 6.72546 numMergedOcc 0
18 mol 79 unq 6 iso 0 dist 9.76351 6.64921 6.29733 4.39227 8.87742 8.84225 numMergedOcc 0
19 mol 79 unq 7 iso 0 dist 9.76351 6.64921 6.29733 8.32896 4.93468 6.72546 numMergedOcc 0
20 mol 93 unq 0 iso 0 dist 8.69945 7.14241 13.5809 11.851 20.0356 7.48947 numMergedOcc 0
21 mol 131 unq 0 iso 0 dist 9.75061 7.34765 4.94367 8.25083 5.87084 8.47526 numMergedOcc 0
22 mol 169 unq 0 iso 0 dist 5.82321 6.27378 6.28646 4.8154 10.616 9.84538 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 8.53237 8.35588 15.0132 9.12063 17.3602 5.68985 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 9.37516 4.93303 10.4367 4.79372 12.3343 6.81516 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 9.37516 9.95859 5.27881 10.2111 11.6403 7.24614 numMergedOcc 0
26 mol 256 unq 0 iso 0 dist 9.74449 7.44294 7.27053 10.3756 4.98734 9.23909 numMergedOcc 0
27 mol 256 unq 1 iso 0 dist 9.74449 7.44294 7.27053 7.80559 11.9984 9.16597 numMergedOcc 0
28 mol 268 unq 0 iso 0 dist 6.68794 9.06348 3.75857 12.0953 10.6704 9.6128 numMergedOcc 0
