0 mol 13 unq 0 iso 0 dist 4.43066 4.14738 7.98465 10.6761 8.27119 14.8035 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.90986 6.77783 9.06516 3.30063 8.97754 7.97596 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.90986 11.7823 9.96121 3.30063 8.97754 8.62111 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.81143 14.4774 7.79336 5.85133 9.41098 16.3505 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 5.40748 4.9516 7.11695 10.3937 9.32314 9.15119 numMergedOcc 0
5 mol 53 unq 1 iso 0 dist 5.40748 5.25639 7.58093 10.3937 9.32314 14.2778 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 9.01601 15.5086 8.35444 12.2062 6.23509 3.75088 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 5.90003 6.02826 6.55202 3.80816 4.55071 3.71283 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 5.56446 7.03121 4.26972 7.06015 5.95801 4.48264 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 5.56446 7.03121 4.26972 6 9.92715 12.3921 numMergedOcc 0
10 mol 141 unq 2 iso 0 dist 5.56446 5.65619 7.54341 7.06015 5.95801 9.42799 numMergedOcc 0
11 mol 141 unq 3 iso 0 dist 5.56446 5.65619 7.54341 6 9.92715 11.3121 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 7.30338 6.39941 7.06851 7.13766 8.21227 7.8982 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 7.85801 7.57363 5.79911 11.9413 6.94187 4.69617 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 7.27503 10.3966 8.5613 9.04755 9.73217 6.03233 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 7.27503 5.51525 5.7791 9.04755 9.73217 7.66564 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.14467 4.59215 8.9466 5.9286 6.22311 4.04301 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 9.14467 4.59215 8.9466 5.9286 6.22311 4.04301 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 9.14467 4.59215 8.9466 5.9286 6.22311 4.04301 numMergedOcc 0
