0 mol 16 unq 0 iso 0 dist 5.59641 6.04965 5.58451 6.06435 7.72142 10.991 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 5.59641 6.32791 5.59769 6.06435 7.72142 6.28033 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 8.52059 8.52979 6.55558 10.6296 6.86785 7.1203 numMergedOcc 0
3 mol 52 unq 1 iso 0 dist 9.99694 8.52979 6.86126 11.2457 9.67023 5.26018 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.6585 7.59663 5.47911 4.9049 8.23618 10.3065 numMergedOcc 0
5 mol 56 unq 1 iso 0 dist 9.71282 7.59663 7.40093 4.27997 9.49909 8.40931 numMergedOcc 0
6 mol 56 unq 2 iso 0 dist 9.71282 7.59663 7.40093 11.9782 8.37022 12.9423 numMergedOcc 0
7 mol 70 unq 0 iso 0 dist 8.85917 9.08867 10.995 4.69046 9.69751 11.0963 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.60664 7.28058 4.49951 5.58441 9.94312 12.4858 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.99189 5.17291 5.31439 14.9018 7.71596 12.1702 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.94097 8.81569 5.31439 15.8508 7.71596 12.1702 numMergedOcc 0
11 mol 94 unq 0 iso 0 dist 8.92072 8.13248 10.4772 6.0782 9.50465 13.1412 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 8.01128 9.58693 9.30656 11.3093 6.2491 5.85841 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 8.01128 9.58693 9.30656 6.41542 3.59451 6.78839 numMergedOcc 0
14 mol 98 unq 2 iso 0 dist 8.01128 9.48388 14.8937 11.3093 6.2491 19.3985 numMergedOcc 0
15 mol 98 unq 3 iso 0 dist 8.01128 9.48388 14.8937 6.41542 3.59451 15.0657 numMergedOcc 0
16 mol 101 unq 0 iso 0 dist 5.58941 8.23251 4.79998 5.23253 5.51185 9.3485 numMergedOcc 0
17 mol 101 unq 1 iso 0 dist 5.58941 7.42893 5.16122 5.23253 5.51185 8.97911 numMergedOcc 0
18 mol 115 unq 0 iso 0 dist 5.77755 6.37427 5.81666 4.70535 6.52501 9.35428 numMergedOcc 0
19 mol 170 unq 0 iso 0 dist 7.70662 7.665 8.83341 5.2781 5.94075 10.867 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 7.38809 6.94983 13.6402 6.24164 7.33708 12.2067 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 7.38809 6.94983 13.6402 6.92292 4.46314 12.5644 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.41308 8.14812 5.09738 6.69333 9.26487 11.1385 numMergedOcc 0
