0 mol 18 unq 0 iso 0 dist 6.60128 9.4649 4.76553 8.1366 13.0944 16.059 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.60128 6.45965 10.8382 8.1366 13.0944 12.619 numMergedOcc 0
2 mol 105 unq 0 iso 0 dist 6.39563 9.46876 3.78099 5.84385 3.85276 7.27819 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 9.47443 7.65299 15.8352 8.96938 15.1144 6.56035 numMergedOcc 0
4 mol 142 unq 0 iso 0 dist 9.02319 7.99533 12.6682 9.28039 10.6977 8.22984 numMergedOcc 0
5 mol 167 unq 0 iso 0 dist 9.15244 9.08229 4.74884 7.71402 12.7113 11.7541 numMergedOcc 0
6 mol 167 unq 1 iso 0 dist 9.15244 9.08229 4.74884 4.74768 5.81715 7.86284 numMergedOcc 0
7 mol 167 unq 2 iso 0 dist 9.15244 7.99057 6.44271 7.71402 12.7113 13.2159 numMergedOcc 0
8 mol 167 unq 3 iso 0 dist 9.15244 7.99057 6.44271 4.74768 5.81715 3.81048 numMergedOcc 0
9 mol 167 unq 4 iso 0 dist 8.08948 9.08229 14.6278 7.71402 10.9557 11.7541 numMergedOcc 0
10 mol 167 unq 5 iso 0 dist 8.08948 9.08229 14.6278 4.74768 7.90903 7.86284 numMergedOcc 0
11 mol 167 unq 6 iso 0 dist 8.08948 7.99057 7.06542 7.71402 10.9557 13.2159 numMergedOcc 0
12 mol 167 unq 7 iso 0 dist 8.08948 7.99057 7.06542 4.74768 7.90903 3.81048 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 9.37716 7.75061 10.6298 9.26152 3.8992 10.5933 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 9.37716 9.11609 5.41212 9.26152 3.8992 5.86358 numMergedOcc 0
15 mol 176 unq 2 iso 0 dist 9.37716 8.85187 8.19458 9.26152 3.8992 6.87729 numMergedOcc 0
16 mol 176 unq 3 iso 0 dist 9.37716 9.44083 14.6456 9.26152 3.8992 14.3748 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 5.97162 9.51189 6.59916 8.13982 10.6238 10.9895 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 6.38821 8.90607 4.55153 6.28518 6.34615 8.46949 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 5.98212 8.90607 6.70754 6.28518 7.07388 8.46949 numMergedOcc 0
20 mol 206 unq 2 iso 0 dist 7.16312 8.90607 5.97851 6.28518 3.76545 8.46949 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 9.7833 9.45685 8.91518 9.95473 6.08595 4.41915 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 7.5129 7.90537 11.113 6.57555 9.39716 4.40935 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 6.55498 9.33149 7.62941 6.02774 3.62492 8.06603 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 7.38219 9.33149 11.4179 6.02774 3.93543 8.06603 numMergedOcc 0
