0 mol 7 unq 0 iso 0 dist 9.49401 17.3986 8.02892 14.8431 6.7985 5.38502 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.49401 17.3986 8.02892 18.245 9.68596 7.39982 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.54052 9.45804 5.7405 10.0565 6.14538 10.4238 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 7.98453 5.23343 6.58279 9.91376 9.49144 8.69921 numMergedOcc 0
4 mol 108 unq 0 iso 0 dist 8.50992 10.135 8.06774 10.051 9.01852 12.692 numMergedOcc 0
5 mol 108 unq 1 iso 0 dist 8.00008 10.6042 8.06774 15.8859 9.01852 12.692 numMergedOcc 0
6 mol 108 unq 2 iso 0 dist 7.79698 7.02959 8.06774 14.7085 9.01852 12.692 numMergedOcc 0
7 mol 108 unq 3 iso 0 dist 7.18748 9.65124 8.06774 4.56297 9.01852 12.692 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 7.38829 10.4884 8.44423 7.78405 9.14926 6.74268 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 7.38829 6.18914 6.16169 7.78405 9.14926 5.11151 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.8891 13.0903 8.35864 16.1376 9.97343 10.4653 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.8891 13.0903 8.35864 10.4675 9.70413 15.1845 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 6.29351 4.20702 8.60394 4.30841 8.73722 7.05464 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 9.83216 6.20034 9.69399 9.58044 9.67741 12.5567 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 9.42877 6.47651 9.47404 6.94473 6.70531 5.61672 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 9.42877 6.47651 9.47404 12.8012 6.86319 14.9157 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 8.73987 6.59509 6.64193 11.1577 7.48463 4.67731 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 8.22952 12.1098 9.61639 6.25661 8.80683 9.11816 numMergedOcc 0
18 mol 226 unq 1 iso 0 dist 8.22952 12.1098 9.61639 9.16105 6.11704 6.92489 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 9.22128 4.96518 6.20377 11.3444 9.55668 12.3562 numMergedOcc 0
20 mol 235 unq 1 iso 0 dist 9.22128 4.96518 6.20377 6.87505 6.95126 5.19684 numMergedOcc 0
21 mol 249 unq 0 iso 0 dist 6.7282 7.89655 4.68783 8.71871 5.48118 9.82483 numMergedOcc 0
22 mol 249 unq 1 iso 0 dist 6.7282 7.89655 4.68783 7.87761 7.25858 9.54906 numMergedOcc 0
