0 mol 21 unq 0 iso 0 dist 8.38921 6.86154 6.08338 16.0937 10.8106 9.34916 10.5369 10.6971 6.93185 11.5409 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.13476 6.2425 5.02241 4.22514 5.65405 8.41365 6.54052 4.29856 6.30987 5.01159 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.63534 6.55474 8.19682 5.25083 6.71804 6.22513 9.2958 6.45686 7.03226 4.80291 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 8.51543 8.36307 6.21982 12.8013 5.49132 6.22513 11.2779 4.85247 7.03226 4.80291 numMergedOcc 0
4 mol 156 unq 0 iso 0 dist 9.25604 5.5355 6.88137 10.6276 5.22807 9.22228 11.8537 6.14767 7.30946 10.5549 numMergedOcc 0
5 mol 173 unq 0 iso 0 dist 9.09857 9.00192 8.31897 17.959 15.713 9.13913 13.1046 10.8609 8.41245 10.735 numMergedOcc 0
6 mol 173 unq 1 iso 0 dist 9.09857 9.00192 8.31897 17.959 15.713 9.13913 6.07708 5.70743 6.64779 14.6187 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 7.15963 9.09192 6.94688 11.981 5.114 9.30874 12.8705 6.6251 9.06217 6.56225 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 7.15963 12.1848 6.71012 11.981 5.114 5.54873 12.8705 6.6251 7.13252 6.56225 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 6.51823 9.28896 6.77463 10.8049 12.3128 7.90344 6.62283 10.4017 8.90076 5.11183 numMergedOcc 0
10 mol 238 unq 1 iso 0 dist 6.51823 9.28896 6.77463 10.8049 12.3128 7.90344 8.60978 7.95232 6.62002 6.32646 numMergedOcc 0
11 mol 238 unq 2 iso 0 dist 6.51823 6.04481 7.2766 15.5617 13.5175 9.83326 6.62283 10.4017 8.09718 15.2051 numMergedOcc 0
12 mol 238 unq 3 iso 0 dist 6.51823 6.04481 7.2766 15.5617 13.5175 9.83326 8.60978 7.95232 6.73446 10.3525 numMergedOcc 0
13 mol 238 unq 4 iso 0 dist 6.51823 6.04481 7.2766 10.3753 7.17967 6.19514 6.62283 10.4017 8.09718 13.5391 numMergedOcc 0
14 mol 238 unq 5 iso 0 dist 6.51823 6.04481 7.2766 10.3753 7.17967 6.19514 8.60978 7.95232 6.73446 9.75263 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 9.86979 10.094 7.19465 14.8241 7.07333 6.52138 15.5271 5.78064 9.58354 5.01342 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.69345 13.2072 7.50578 21.1416 15.6082 9.418 18.4046 14.3125 8.92185 4.34105 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.69345 13.2072 7.50578 18.7885 10.5525 8.10823 18.4046 14.3125 8.92185 11.2938 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 9.12551 10.7029 4.86729 11.726 5.87119 8.6173 13.1896 4.50325 6.61376 4.47263 numMergedOcc 0
