0 mol 20 unq 0 iso 0 dist 7.6876 8.91975 5.0973 9.63181 7.81123 10.5266 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.67955 6.5461 11.4412 9.67946 5.77186 12.9801 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 6.59687 9.14653 6.32776 6.68029 8.79502 9.243 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 8.25891 6.01135 6.93183 5.70431 5.86791 4.07844 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 9.37955 5.72034 6.27718 8.52499 5.04643 3.67112 numMergedOcc 0
5 mol 75 unq 1 iso 0 dist 9.16165 6.15203 6.27718 6.2449 5.04643 3.67112 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 8.05582 7.0847 11.1733 6.07433 5.21899 11.7659 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 7.18661 9.13904 4.95433 8.99674 8.07487 12.1497 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 7.18661 7.10245 5.26505 8.99674 8.07487 9.73719 numMergedOcc 0
9 mol 136 unq 0 iso 0 dist 7.79731 9.12669 10.2102 9.2211 12.1315 12.7228 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 7.29604 9.14728 14.4138 8.67001 4.91809 13.1991 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 8.63478 8.67447 13.9699 6.8795 7.1759 10.9471 numMergedOcc 0
12 mol 260 unq 1 iso 0 dist 8.08865 8.67447 5.02615 6.8795 8.60998 10.9471 numMergedOcc 0
13 mol 272 unq 0 iso 0 dist 6.2083 9.97008 9.82665 9.1926 6.02611 14.8278 numMergedOcc 0
14 mol 272 unq 1 iso 0 dist 6.2083 9.97008 9.82665 9.17894 13.4883 17.2633 numMergedOcc 0
15 mol 272 unq 2 iso 0 dist 6.2083 5.98984 7.58936 9.1926 6.02611 6.20439 numMergedOcc 0
16 mol 272 unq 3 iso 0 dist 6.2083 5.98984 7.58936 9.17894 13.4883 6.59992 numMergedOcc 0
17 mol 272 unq 4 iso 0 dist 6.2083 4.90884 9.12449 9.1926 6.02611 8.75151 numMergedOcc 0
18 mol 272 unq 5 iso 0 dist 6.2083 4.90884 9.12449 9.17894 13.4883 4.70157 numMergedOcc 0
19 mol 272 unq 6 iso 0 dist 9.39756 5.75554 5.35227 8.16917 13.0786 8.47076 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.13071 7.17626 4.70335 8.82948 7.26562 5.41757 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 8.19596 7.17626 9.38112 8.82948 11.1391 5.41757 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.13071 7.17626 4.70335 8.82948 7.26562 5.41757 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 8.19596 7.17626 9.38112 8.82948 11.1391 5.41757 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 9.13071 7.17626 4.70335 8.82948 7.26562 5.41757 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 8.19596 7.17626 9.38112 8.82948 11.1391 5.41757 numMergedOcc 0
