0 mol 27 unq 0 iso 0 dist 9.76721 13.2287 8.57551 8.05284 9.94082 15.4799 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 9.76721 14.8458 9.32506 8.05284 9.94082 14.1714 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 4.7864 7.18353 9.57666 5.25639 7.99981 7.25227 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 5.11803 5.68632 8.72121 4.22408 6.51618 5.85828 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 5.11803 5.68632 8.72121 5.11651 8.77748 9.39758 numMergedOcc 0
5 mol 107 unq 0 iso 0 dist 8.83855 12.4695 6.99676 14.1277 9.00913 5.95601 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.13829 12.314 7.82186 11.7838 8.48405 15.911 numMergedOcc 0
7 mol 120 unq 1 iso 0 dist 9.13829 14.2862 5.85006 11.7838 8.48405 8.33981 numMergedOcc 0
8 mol 120 unq 2 iso 0 dist 5.90276 9.31366 7.82186 9.34774 8.48405 15.911 numMergedOcc 0
9 mol 120 unq 3 iso 0 dist 5.90276 9.8665 5.85006 9.34774 8.48405 8.33981 numMergedOcc 0
10 mol 120 unq 4 iso 0 dist 8.565 14.5868 7.82186 6.20311 8.48405 15.911 numMergedOcc 0
11 mol 120 unq 5 iso 0 dist 8.565 4.15475 5.85006 6.20311 8.48405 8.33981 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 9.19804 13.7645 8.9675 6.93656 7.18359 7.06802 numMergedOcc 0
13 mol 154 unq 1 iso 0 dist 9.19804 13.7645 8.9675 10.0808 7.66303 6.88913 numMergedOcc 0
14 mol 174 unq 0 iso 0 dist 8.99695 7.31124 4.97597 4.77302 6.29723 6.26251 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 7.39089 14.2074 7.43688 4.12468 5.31262 10.8902 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 7.39089 5.80426 5.50716 4.12468 5.31262 5.83664 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 7.81415 9.48513 6.69313 6.35551 7.8959 7.77456 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 8.25719 6.36882 8.73473 9.57523 6.86467 5.07543 numMergedOcc 0
