0 mol 34 unq 0 iso 0 dist 9.12062 6.20159 10.4051 7.66913 10.8394 11.3492 numMergedOcc 0
1 mol 70 unq 0 iso 0 dist 9.2794 9.54062 10.838 6.13606 4.12515 11.4024 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.75708 6.35752 12.3421 8.64736 12.7681 3.69039 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.75708 8.88238 11.0685 8.64736 12.7681 15.0328 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 9.12919 8.32098 9.50386 7.32157 11.2869 10.0734 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 7.32868 7.69672 5.71215 6.15011 11.8069 12.4367 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.00111 9.39787 13.5465 8.51206 9.80356 4.31811 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 7.65299 8.96938 6.56035 9.39356 4.08294 4.06012 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 9.71025 5.7306 10.3934 8.85675 10.3128 11.9741 numMergedOcc 0
9 mol 169 unq 0 iso 0 dist 9.19569 6.58855 5.98157 8.59976 11.3012 13.1373 numMergedOcc 0
10 mol 169 unq 1 iso 0 dist 9.19569 6.58855 5.98157 9.71763 9.12553 12.3204 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.51189 8.13982 10.9895 6.19189 11.2568 7.65999 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 8.51112 8.77346 8.93396 5.0778 4.58275 6.12638 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 8.95136 6.254 12.6877 6.32542 4.8012 8.16279 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 7.18 5.35602 9.55395 8.3505 9.86077 4.00393 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 8.95503 7.70125 5.4902 7.51337 5.98513 7.66364 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 8.95503 7.70125 5.4902 8.05594 6.31674 3.7016 numMergedOcc 0
17 mol 240 unq 0 iso 0 dist 9.23116 7.43296 6.5325 4.98994 9.50907 5.85774 numMergedOcc 0
18 mol 240 unq 1 iso 0 dist 5.76042 7.43296 4.6158 4.98994 5.30432 5.85774 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 6.58667 7.89017 11.5085 7.64361 13.7282 6.17749 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 6.01542 7.89017 3.5373 7.64361 4.60075 6.17749 numMergedOcc 0
