0 mol 62 unq 0 iso 0 dist 9.65672 8.84323 6.03786 6.35779 7.31044 5.27573 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 8.34804 5.70192 13.1761 8.4702 8.43533 11.4786 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.68781 9.28803 5.74801 9.853 5.61965 5.14042 numMergedOcc 0
3 mol 117 unq 0 iso 0 dist 9.83596 8.0578 9.55722 6.01857 6.41211 4.18875 numMergedOcc 0
4 mol 123 unq 0 iso 0 dist 8.56386 6.7201 7.32307 8.30974 13.0523 6.04079 numMergedOcc 0
5 mol 123 unq 1 iso 0 dist 7.15869 6.7201 8.8027 8.30974 6.41552 6.04079 numMergedOcc 0
6 mol 151 unq 0 iso 0 dist 5.62891 8.00027 4.64142 6.12972 4.5975 4.0895 numMergedOcc 0
7 mol 163 unq 0 iso 0 dist 8.66172 8.70104 13.2873 9.37245 16.5748 12.8567 numMergedOcc 0
8 mol 163 unq 1 iso 0 dist 6.89529 8.70104 10.4425 9.37245 4.09125 12.8567 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 9.15795 7.42108 14.3873 7.16035 7.09962 8.87705 numMergedOcc 0
10 mol 183 unq 1 iso 0 dist 9.15795 7.42108 14.3873 6.2675 10.5443 4.56996 numMergedOcc 0
11 mol 185 unq 0 iso 0 dist 8.2968 8.60027 4.72576 9.1549 5.55352 3.6106 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 5.33103 6.87234 10.514 9.49242 13.5812 5.35359 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 5.33103 6.87234 10.514 9.25184 10.061 13.2257 numMergedOcc 0
14 mol 210 unq 2 iso 0 dist 5.33103 8.72017 8.55471 9.49242 13.5812 10.8507 numMergedOcc 0
15 mol 210 unq 3 iso 0 dist 5.33103 8.72017 8.55471 9.25184 10.061 14.6808 numMergedOcc 0
16 mol 210 unq 4 iso 0 dist 9.01301 6.87234 12.685 9.49242 12.9549 5.35359 numMergedOcc 0
17 mol 210 unq 5 iso 0 dist 9.01301 6.87234 12.685 9.25184 5.11839 13.2257 numMergedOcc 0
18 mol 210 unq 6 iso 0 dist 9.01301 8.72017 11.7269 9.49242 12.9549 10.8507 numMergedOcc 0
19 mol 210 unq 7 iso 0 dist 9.01301 8.72017 11.7269 9.25184 5.11839 14.6808 numMergedOcc 0
20 mol 247 unq 0 iso 0 dist 8.21164 9.76925 4.15871 4.78189 6.27547 6.27561 numMergedOcc 0
21 mol 247 unq 1 iso 0 dist 8.40674 9.76925 12.9672 4.78189 7.88685 6.27561 numMergedOcc 0
22 mol 247 unq 2 iso 0 dist 6.09851 9.76925 11.7419 4.78189 8.43878 6.27561 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 5.76796 8.96754 8.9423 6.73396 4.57431 6.01515 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 6.90956 9.94507 5.75008 9.1471 6.33641 5.29113 numMergedOcc 0
25 mol 287 unq 1 iso 0 dist 6.90956 9.94507 5.75008 7.84189 12.0298 11.7964 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 6.90956 9.94507 5.75008 9.1471 6.33641 5.29113 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 6.90956 9.94507 5.75008 7.84189 12.0298 11.7964 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 6.90956 9.94507 5.75008 9.1471 6.33641 5.29113 numMergedOcc 0
29 mol 289 unq 1 iso 0 dist 6.90956 9.94507 5.75008 7.84189 12.0298 11.7964 numMergedOcc 0
