0 mol 0 unq 0 iso 0 dist 8.9753 10.4086 9.00092 10.8767 3.68241 7.31837 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 9.1791 4.7391 7.58739 5.35101 7.4999 5.84625 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 6.86485 4.7391 9.01564 5.35101 4.99692 5.84625 numMergedOcc 0
3 mol 58 unq 2 iso 0 dist 8.37546 4.7391 7.11065 5.35101 3.70586 5.84625 numMergedOcc 0
4 mol 58 unq 3 iso 0 dist 8.26586 4.35705 7.58739 8.68381 7.4999 5.84625 numMergedOcc 0
5 mol 58 unq 4 iso 0 dist 9.76234 4.35705 9.01564 8.68381 4.99692 5.84625 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 8.8014 6.78661 7.98985 10.6838 6.4113 7.07989 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 8.8014 6.78661 7.98985 15.7397 16.2411 9.77272 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 6.64714 5.75219 8.77355 7.62621 6.44712 5.51406 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 9.61144 5.60623 6.59716 10.8431 5.92795 5.59552 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 6.13521 5.60623 6.87506 10.8431 10.2656 5.59552 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 9.43355 16.0131 7.28831 8.84466 3.91263 7.4518 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 9.43355 11.7408 9.71411 8.84466 3.91263 9.1687 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 8.62413 6.02377 6.34626 13.0583 4.45029 9.86988 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.33743 8.11294 8.83732 9.22456 5.68827 9.04845 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 7.33743 8.11294 8.83732 13.5693 10.124 7.94325 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 7.33743 8.11294 8.83732 5.7232 11.5628 6.72323 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.19831 6.15536 8.59681 8.94464 7.88733 9.07527 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 7.83476 4.19412 8.12266 11.8438 9.00952 9.07527 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 8.79662 10.4451 8.23406 12.3791 5.96186 5.89818 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 8.22129 5.79979 6.59036 10.2295 6.54593 7.83422 numMergedOcc 0
21 mol 273 unq 0 iso 0 dist 7.05843 5.91547 5.61969 9.89677 13.255 9.78826 numMergedOcc 0
