0 mol 8 unq 0 iso 0 dist 5.89089 4.16129 5.68648 8.10767 7.03958 9.35502 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 4.89563 6.05868 6.82187 4.98085 5.89412 7.49229 numMergedOcc 0
2 mol 15 unq 1 iso 0 dist 6.16274 5.75573 6.60595 5.00898 6.42748 7.11548 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 9.55169 13.4017 8.58312 11.1103 9.78331 4.47542 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 9.74892 8.7712 5.52992 6.31452 8.83487 4.61383 numMergedOcc 0
5 mol 65 unq 0 iso 0 dist 9.58906 5.3232 9.16749 4.59764 7.90294 5.82003 numMergedOcc 0
6 mol 101 unq 0 iso 0 dist 7.42893 10.3211 8.65215 9.31844 6.98314 4.93063 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 6.97244 14.7727 9.32858 6.85703 7.70232 10.8848 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 6.97244 14.7727 9.32858 9.39186 7.4671 9.26317 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.5778 13.4768 8.86784 6.89623 7.80532 12.3839 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 7.47249 6.16238 9.32245 5.34021 6.35982 4.11212 numMergedOcc 0
11 mol 170 unq 1 iso 0 dist 7.47249 6.16238 9.32245 5.01799 7.51126 9.2613 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 9.84636 11.013 8.02366 6.84084 7.33273 6.49767 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 6.32172 3.94722 9.06702 5.00423 6.73956 7.42577 numMergedOcc 0
14 mol 182 unq 1 iso 0 dist 6.32172 3.94722 9.06702 5.41536 7.09394 4.49268 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 9.65951 17.5501 9.44947 16.909 9.68728 4.29037 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 9.14829 16.4106 9.44947 14.2441 9.68728 4.29037 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 8.58958 13.8173 5.46736 18.0206 9.81425 6.30638 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 9.70004 10.6347 5.46736 15.0011 9.81425 6.30638 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 9.14351 13.2696 6.26142 5.56847 5.48118 9.55793 numMergedOcc 0
20 mol 271 unq 0 iso 0 dist 7.59727 6.04262 9.42899 5.88597 9.70714 11.0964 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 6.23184 4.36007 6.84604 10.5063 6.62841 10.7698 numMergedOcc 0
