0 mol 18 unq 0 iso 0 dist 9.2978 7.37356 10.1903 5.13088 9.55948 10.5902 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.90024 6.84521 5.06502 14.6778 8.03754 12.7352 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 6.78532 6.45462 14.6778 8.03754 10.5813 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 6.78532 6.84521 5.89973 5.9674 9.47348 12.0317 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 6.78532 8.90024 6.45462 5.9674 9.47348 12.0919 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.27307 6.92837 8.99811 7.18248 7.25721 10.6812 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.29446 5.8992 11.5966 5.64101 5.68286 10.4792 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 7.4389 7.24527 4.98336 4.83143 9.41191 10.501 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 6.99793 6.71345 11.6284 5.0271 8.14429 10.8086 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.66715 9.00172 8.18495 16.6927 9.1146 15.6213 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.84656 4.68975 7.11631 15.0514 6.48328 13.3377 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 8.84656 4.9155 5.00817 15.0514 6.48328 11.0053 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 4.9155 4.68975 5.79898 12.4563 8.86784 13.8807 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 4.9155 8.84656 5.00817 12.4563 8.86784 11.3169 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 7.34207 6.44195 9.41666 6.84292 6.36439 11.8209 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 6.53913 7.9895 9.36756 13.5763 9.23645 16.452 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 6.18446 9.96544 5.43601 4.80458 8.67786 10.1566 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 6.88694 6.32302 5.57838 5.19315 8.83023 10.7513 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 9.07222 9.09998 5.84541 7.3073 6.43046 10.5801 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 9.09998 9.07222 5.84541 5.05395 9.79948 12.2223 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 7.23956 7.151 11.8268 10.2688 4.81916 14.8509 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 7.23956 8.53324 7.08227 10.2688 4.81916 9.92831 numMergedOcc 0
