0 mol 53 unq 0 iso 0 dist 9.23241 6.76039 8.83047 11.9999 13.3355 8.94173 numMergedOcc 0
1 mol 53 unq 1 iso 0 dist 9.23241 14.2926 6.95013 16.0417 8.64107 8.62669 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 9.7171 4.36597 9.39702 4.99966 6.29991 7.55805 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 7.49224 12.1962 7.73993 17.2949 11.8348 7.4371 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 7.98999 9.87475 6.48223 7.15985 3.98564 5.81552 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 7.62584 5.11455 4.85559 10.9469 5.97111 9.05626 numMergedOcc 0
6 mol 130 unq 1 iso 0 dist 7.39532 7.43279 4.85559 5.49877 5.97111 9.05626 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 9.2042 7.10961 6.31314 6.23399 6.55507 9.04554 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 9.3832 14.7097 9.02124 13.816 6.94217 6.56115 numMergedOcc 0
9 mol 163 unq 1 iso 0 dist 6.0247 12.8414 9.02124 11.6021 6.94217 6.56115 numMergedOcc 0
10 mol 163 unq 2 iso 0 dist 6.40873 14.9092 9.02124 13.0625 6.94217 6.56115 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 7.68295 5.24208 6.81707 6.07091 5.487 6.01711 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 5.76772 4.52935 7.70692 8.1088 5.5127 8.70197 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 5.36078 7.46995 4.0037 13.1215 10.7924 8.84671 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.47421 14.9776 8.74308 18.1217 14.4635 9.08672 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 8.25445 6.31111 7.25797 8.59986 7.26083 7.72749 numMergedOcc 0
16 mol 272 unq 0 iso 0 dist 8.36282 14.2164 7.11691 16.7222 8.7909 4.78812 numMergedOcc 0
17 mol 272 unq 1 iso 0 dist 8.36282 14.2164 7.11691 12.3257 4.86504 6.62923 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 9.89698 16.839 9.4626 9.87411 7.52207 9.81087 numMergedOcc 0
