0 mol 7 unq 0 iso 0 dist 9.14481 9.9698 8.41585 8.04923 12.0193 5.99972 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 8.55448 5.40479 4.61088 9.47506 6.86684 5.96346 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 8.62361 11.5456 7.34143 12.8351 6.66056 6.31696 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.66233 12.3075 6.83299 11.729 4.29856 6.14538 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 5.88766 9.84851 6.83299 10.0144 4.29856 6.14538 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.3906 7.8601 7.71095 11.6947 9.64444 6.73347 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 7.41568 7.8601 8.25513 11.6947 6.66692 6.73347 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.9925 6.79221 8.70481 15.2653 15.3808 9.24757 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.11094 6.59988 5.08437 6.56503 4.4057 6.65501 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.91249 5.04286 5.08437 9.92781 7.06961 6.7117 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 7.91249 10.4243 6.10456 9.92781 7.06961 4.47349 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 7.21175 6.59988 6.48948 6.56503 7.42446 6.65501 numMergedOcc 0
12 mol 98 unq 4 iso 0 dist 7.94919 10.5282 5.08437 6.56349 7.06961 6.7117 numMergedOcc 0
13 mol 98 unq 5 iso 0 dist 7.94919 6.5508 6.10456 6.56349 7.06961 4.47349 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 6.70974 7.84178 5.86073 8.26447 10.1816 8.8822 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 6.70974 7.84178 5.86073 6.71684 8.42718 9.66219 numMergedOcc 0
16 mol 113 unq 2 iso 0 dist 7.37883 7.56889 5.86073 12.456 10.1816 8.8822 numMergedOcc 0
17 mol 113 unq 3 iso 0 dist 7.37883 7.56889 5.86073 11.6044 8.42718 9.66219 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 5.47457 9.36947 8.22656 13.0284 10.6025 7.71248 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 9.88039 7.46731 6.57069 6.95556 8.29015 9.77896 numMergedOcc 0
20 mol 248 unq 0 iso 0 dist 8.32148 6.55266 9.56569 8.33005 4.30004 7.16525 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 7.62761 8.12266 6.24356 8.56593 5.00209 7.16853 numMergedOcc 0
