0 mol 12 unq 0 iso 0 dist 6.13335 4.85969 4.13477 6.16894 8.59097 4.62913 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 6.13335 4.85969 4.13477 5.93993 5.44478 7.44542 numMergedOcc 0
2 mol 86 unq 0 iso 0 dist 5.37706 6.17345 4.4104 6.55202 9.59708 8.32885 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 7.98923 7.81363 12.4809 10.5952 17.6783 6.91081 numMergedOcc 0
4 mol 128 unq 0 iso 0 dist 9.36937 5.32517 8.76554 8.86016 16.3808 9.50023 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.86332 5.63173 4.77272 11.8191 4.46578 8.61448 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.49149 8.47476 14.125 13.6955 21.4771 9.28415 numMergedOcc 0
7 mol 188 unq 0 iso 0 dist 9.63715 8.72253 7.76882 5.11822 12.8878 9.4789 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 9.71975 5.29176 5.87489 8.26563 7.5696 8.40718 numMergedOcc 0
9 mol 233 unq 0 iso 0 dist 5.68392 8.83541 5.49245 5.35285 7.5099 6.87565 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 6.2587 6.38338 7.88871 5.87542 11.5828 6.90956 numMergedOcc 0
11 mol 288 unq 0 iso 0 dist 6.2587 6.38338 7.88871 5.87542 11.5828 6.90956 numMergedOcc 0
12 mol 289 unq 0 iso 0 dist 6.2587 6.38338 7.88871 5.87542 11.5828 6.90956 numMergedOcc 0
