0 mol 42 unq 0 iso 0 dist 9.50049 8.14608 5.52834 5.47751 6.51963 6.79455 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 7.85826 7.26196 5.66803 10.0119 7.77991 10.0913 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 7.85826 7.26196 5.66803 10.078 5.1488 5.68492 numMergedOcc 0
3 mol 64 unq 2 iso 0 dist 7.85826 7.27834 8.85416 10.0119 7.77991 8.21081 numMergedOcc 0
4 mol 64 unq 3 iso 0 dist 7.85826 7.27834 8.85416 10.078 5.1488 11.6323 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.93939 16.0604 8.90896 11.4785 6.96647 13.1044 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.69413 7.89197 9.06641 9.00479 8.95044 4.46847 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 7.09179 8.38134 6.61973 9.1401 9.49798 10.3223 numMergedOcc 0
8 mol 116 unq 1 iso 0 dist 7.09179 8.38134 6.61973 10.0719 8.31955 12.8624 numMergedOcc 0
9 mol 116 unq 2 iso 0 dist 9.31875 5.88698 6.61973 12.6748 9.49798 10.3223 numMergedOcc 0
10 mol 116 unq 3 iso 0 dist 9.31875 5.88698 6.61973 15.177 8.31955 12.8624 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.61918 13.2228 5.79195 16.4387 8.03691 7.50288 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 8.61918 15.392 9.2759 16.4387 8.03691 8.01541 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 8.61918 15.6785 8.76088 16.4387 8.03691 5.31306 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 9.89646 12.352 5.32865 16.5433 9.80032 10.7118 numMergedOcc 0
15 mol 147 unq 1 iso 0 dist 9.9332 10.4422 5.32865 14.8903 9.80032 10.7118 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 7.90753 7.11843 9.40718 5.98221 9.23089 10.602 numMergedOcc 0
17 mol 183 unq 0 iso 0 dist 6.23903 7.14992 8.97652 6.93732 8.55287 13.7069 numMergedOcc 0
18 mol 183 unq 1 iso 0 dist 8.39603 10.0544 8.97652 12.0539 8.55287 13.7069 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 8.82741 7.50159 4.64178 11.562 8.75924 10.8902 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 8.82741 14.8655 9.16988 11.562 8.75924 5.83664 numMergedOcc 0
21 mol 243 unq 2 iso 0 dist 4.88105 4.7112 4.64178 7.2163 8.75924 10.8902 numMergedOcc 0
22 mol 243 unq 3 iso 0 dist 4.88105 9.56957 9.16988 7.2163 8.75924 5.83664 numMergedOcc 0
23 mol 243 unq 4 iso 0 dist 9.44057 8.85604 4.64178 5.97613 8.75924 10.8902 numMergedOcc 0
24 mol 243 unq 5 iso 0 dist 9.44057 6.36228 9.16988 5.97613 8.75924 5.83664 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 8.65743 5.36882 9.62494 8.1524 9.85022 12.9391 numMergedOcc 0
