0 mol 11 unq 0 iso 0 dist 6.40513 5.83448 6.84216 11.8254 10.7734 9.81983 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 6.53817 7.83348 8.70792 6.80314 4.03817 5.16502 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.35095 6.85946 8.23075 9.89331 5.11617 7.85986 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.35095 6.85662 4.7841 10.2645 4.50066 7.03544 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.35095 6.85662 4.7841 9.89331 5.11617 4.30252 numMergedOcc 0
5 mol 36 unq 0 iso 0 dist 6.29647 4.28628 5.79779 9.53334 5.52411 8.37681 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 5.36645 5.39197 7.15542 6.42242 8.82805 7.20729 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 5.49623 6.51961 5.25027 11.625 7.23157 6.2576 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 5.49623 6.51961 5.25027 15.1951 12.5946 8.96069 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 5.49623 6.51961 5.25027 11.3356 9.69296 7.56495 numMergedOcc 0
10 mol 79 unq 3 iso 0 dist 5.49623 4.08459 4.37025 9.22889 6.54837 5.79139 numMergedOcc 0
11 mol 79 unq 4 iso 0 dist 5.49623 4.08459 4.37025 11.3356 9.69296 7.63923 numMergedOcc 0
12 mol 102 unq 0 iso 0 dist 9.0361 6.04036 5.54256 9.2062 4.48396 6.07633 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 5.30872 7.33175 8.64905 12.5653 10.4028 7.2932 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.89142 7.86779 7.93088 9.31025 4.20425 5.67088 numMergedOcc 0
15 mol 162 unq 1 iso 0 dist 9.89142 7.86779 7.93088 13.7906 6.45822 9.61332 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 7.10166 8.44261 6.23183 11.0073 7.67029 5.17607 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 8.73396 6.30581 4.51255 10.1577 4.62682 5.17607 numMergedOcc 0
18 mol 206 unq 2 iso 0 dist 9.66896 13.8891 6.23183 14.2242 7.67029 5.17607 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 7.47238 6.89215 8.25985 9.78197 4.9377 9.78273 numMergedOcc 0
20 mol 256 unq 0 iso 0 dist 8.43264 5.24147 4.80903 7.54955 5.28793 4.36333 numMergedOcc 0
21 mol 256 unq 1 iso 0 dist 8.43264 5.24147 4.80903 11.9361 4.99672 6.96483 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 8.50313 4.0136 8.24356 10.2519 6.18925 9.41212 numMergedOcc 0
23 mol 261 unq 1 iso 0 dist 7.6414 4.30068 8.24356 6.45102 6.18925 9.41212 numMergedOcc 0
