0 mol 6 unq 0 iso 0 dist 7.8489 8.96036 11.1845 4.94534 9.47965 11.6828 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 6.64067 8.26423 8.93644 4.58234 6.34078 10.2645 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 6.64067 8.21972 12.1723 4.58234 6.34078 12.1985 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 8.91055 8.60438 4.59148 4.77259 9.28585 6.6146 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 8.94991 5.22576 6.16048 11.4044 9.83906 10.1004 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.8763 8.84955 14.6504 12.3783 6.71671 20.0256 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 6.4822 8.04823 3.56357 10.9571 6.32669 8.56593 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 9.70166 9.12896 5.55359 8.40223 7.19213 7.00683 numMergedOcc 0
8 mol 218 unq 0 iso 0 dist 6.44877 6.35646 7.15853 5.01938 6.2441 4.61671 numMergedOcc 0
9 mol 218 unq 1 iso 0 dist 6.44877 5.59354 5.7173 5.01938 6.2441 8.44004 numMergedOcc 0
10 mol 236 unq 0 iso 0 dist 5.40329 7.73969 6.0905 5.12276 8.01164 12.3547 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 9.44043 9.27225 9.26732 11.7532 6.18894 14.9694 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 8.40448 9.72665 12.8228 4.80106 4.75866 9.98985 numMergedOcc 0
