0 mol 0 unq 0 iso 0 dist 7.79297 9.17475 7.46173 6.73401 9.67081 8.05095 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.06275 10.8481 6.79185 7.62357 9.02471 11.9382 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 6.66818 6.79185 16.9091 9.02471 11.9382 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 9.43143 12.6797 8.96978 10.2533 4.86198 9.59421 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.96446 14.0484 7.48658 12.0126 5.42067 7.43075 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 7.24527 11.9937 9.97334 4.61206 9.63963 10.5017 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 7.77678 10.5289 6.2967 10.0513 9.10911 7.95278 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 9.70016 13.7186 8.57673 13.586 9.59585 17.4221 numMergedOcc 0
8 mol 113 unq 1 iso 0 dist 9.70016 13.7186 8.57673 5.90637 9.7073 14.9096 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 6.44195 6.31686 7.74216 5.71332 8.89394 7.49611 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 7.39185 6.59104 6.42016 4.22848 6.59544 4.65969 numMergedOcc 0
11 mol 195 unq 1 iso 0 dist 4.78641 7.78918 6.42016 4.65343 6.59544 4.65969 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 9.73691 13.8211 8.96646 6.56215 9.09354 16.0616 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 9.73691 13.8211 8.96646 9.18934 4.66576 7.70759 numMergedOcc 0
14 mol 213 unq 2 iso 0 dist 9.73691 14.9053 7.2016 6.56215 9.09354 15.2721 numMergedOcc 0
15 mol 213 unq 3 iso 0 dist 9.73691 14.9053 7.2016 9.18934 4.66576 6.53554 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.82778 7.87346 6.8597 10.7268 4.43499 5.93732 numMergedOcc 0
17 mol 240 unq 0 iso 0 dist 7.6664 8.025 7.55134 3.99769 5.77749 4.16135 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 9.13226 5.04646 6.92434 8.82131 9.83622 4.66257 numMergedOcc 0
19 mol 274 unq 1 iso 0 dist 9.13226 13.7104 6.93875 8.82131 9.83622 11.6391 numMergedOcc 0
20 mol 274 unq 2 iso 0 dist 9.13226 15.0989 6.0868 8.82131 9.83622 13.2973 numMergedOcc 0
21 mol 274 unq 3 iso 0 dist 9.13226 14.8539 6.32856 8.82131 9.83622 14.8955 numMergedOcc 0
