0 mol 24 unq 0 iso 0 dist 6.48457 8.09311 13.862 13.2846 7.18124 20.7084 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.48457 8.09311 13.862 12.3897 6.47026 19.6607 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.48457 9.05357 9.94168 13.2846 7.18124 14.6978 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.48457 9.05357 9.94168 12.3897 6.47026 15.4732 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 9.18809 9.8703 5.69088 10.9724 8.32093 8.19932 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 4.69674 7.12321 6.75732 4.7874 6.48394 10.6615 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 8.72013 6.85523 14.5311 12.3916 9.15754 17.3107 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 8.72013 5.77326 7.35317 12.3916 9.15754 12.7519 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 6.4687 9.24724 9.00471 5.62545 7.15043 13.9322 numMergedOcc 0
9 mol 81 unq 1 iso 0 dist 6.4687 9.24724 9.00471 8.0518 5.70283 13.9685 numMergedOcc 0
10 mol 81 unq 2 iso 0 dist 6.67147 9.24724 10.7554 5.62545 5.86142 13.9322 numMergedOcc 0
11 mol 81 unq 3 iso 0 dist 6.67147 9.24724 10.7554 8.0518 7.16741 13.9685 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 8.81824 7.7068 9.85117 16.2205 9.43843 15.1241 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 8.81824 7.7068 9.85117 8.37717 7.67463 13.4949 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 8.10448 8.28795 4.13685 5.49724 7.39112 9.87354 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 8.86966 6.70693 10.8368 4.73288 7.78215 10.6225 numMergedOcc 0
16 mol 170 unq 0 iso 0 dist 6.01758 9.08274 9.2385 8.46965 5.14196 10.6388 numMergedOcc 0
17 mol 178 unq 0 iso 0 dist 8.4173 7.06025 7.86021 4.69387 6.53017 9.15383 numMergedOcc 0
18 mol 178 unq 1 iso 0 dist 8.4173 7.06025 7.86021 13.6551 8.83695 16.1839 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 7.23959 6.52816 5.19623 6.49049 8.42716 4.97301 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 5.62219 8.63693 3.61565 5.29041 9.41473 11.1484 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 7.48298 7.15764 9.49612 7.63636 9.84342 14.3744 numMergedOcc 0
22 mol 252 unq 1 iso 0 dist 7.48298 7.15764 9.49612 9.93981 8.63893 9.81261 numMergedOcc 0
23 mol 252 unq 2 iso 0 dist 8.9483 7.15764 10.6529 7.63636 9.85159 14.3744 numMergedOcc 0
