0 mol 64 unq 0 iso 0 dist 8.8633 6.46589 3.91131 5.70508 11.2434 8.92221 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.34966 5.88256 7.71726 4.58473 7.98985 5.7369 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 5.79841 6.2454 10.8586 7.75121 13.3607 8.16401 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 9.75656 6.88696 10.0279 5.96497 10.1088 7.31064 numMergedOcc 0
4 mol 162 unq 0 iso 0 dist 9.25835 9.95076 16.3342 5.09521 14.2344 9.43904 numMergedOcc 0
5 mol 162 unq 1 iso 0 dist 9.25835 7.76112 14.6018 5.09521 14.2344 7.01095 numMergedOcc 0
6 mol 206 unq 0 iso 0 dist 6.69623 5.83021 5.70985 5.84459 11.0686 9.95026 numMergedOcc 0
7 mol 206 unq 1 iso 0 dist 6.69623 5.83021 5.70985 4.25315 8.24419 9.09594 numMergedOcc 0
8 mol 206 unq 2 iso 0 dist 6.21951 9.18711 5.70985 7.76853 11.0686 9.95026 numMergedOcc 0
9 mol 206 unq 3 iso 0 dist 6.21951 9.18711 5.70985 4.89614 8.24419 9.09594 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 7.43301 5.79617 3.91276 7.78712 12.9546 9.43017 numMergedOcc 0
11 mol 217 unq 0 iso 0 dist 9.37899 5.27487 9.33845 13.3672 17.9393 9.37602 numMergedOcc 0
12 mol 217 unq 1 iso 0 dist 9.37899 5.27487 9.33845 8.6943 17.0198 8.26522 numMergedOcc 0
13 mol 217 unq 2 iso 0 dist 6.14304 5.27487 9.98266 13.3672 16.9806 9.37602 numMergedOcc 0
14 mol 217 unq 3 iso 0 dist 6.14304 5.27487 9.98266 8.6943 12.9961 8.26522 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 6.6069 9.0735 5.8463 7.30721 6.94762 9.3502 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 6.6069 9.0735 5.8463 5.22792 9.89167 9.34821 numMergedOcc 0
17 mol 225 unq 2 iso 0 dist 6.6069 9.0735 5.8463 10.0058 10.1785 6.46405 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 5.92532 8.18813 6.64795 13.3706 9.26157 7.16209 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 5.92532 8.18813 6.64795 12.1739 9.11117 4.62936 numMergedOcc 0
