0 mol 11 unq 0 iso 0 dist 9.62742 6.49709 6.64342 11.1196 12.2735 6.40513 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.77251 7.62383 5.70356 5.75835 6.45963 6.03755 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 7.74299 7.62383 4.83051 5.75835 8.70819 6.03755 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 4.74307 6.81152 5.53748 5.36545 8.49449 6.25914 numMergedOcc 0
4 mol 55 unq 3 iso 0 dist 6.36082 6.81152 4.53728 5.36545 6.45963 6.25914 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 6.59061 5.21803 4.7924 10.3808 13.7826 9.42819 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 9.15244 6.53913 7.79718 10.1351 15.336 7.83781 numMergedOcc 0
7 mol 167 unq 1 iso 0 dist 8.08948 6.53913 12.3929 10.1351 16.9105 7.83781 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 6.38821 9.90891 13.8408 11.0055 12.7251 9.89167 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 5.98212 9.90891 11.5281 11.0055 15.7438 9.89167 numMergedOcc 0
10 mol 206 unq 2 iso 0 dist 7.16312 9.90891 15.4153 11.0055 17.2776 9.89167 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.01913 8.14644 15.7646 6.4634 9.64006 8.9077 numMergedOcc 0
12 mol 256 unq 0 iso 0 dist 9.51909 9.51272 5.59478 9.39044 9.34785 7.54586 numMergedOcc 0
13 mol 256 unq 1 iso 0 dist 7.00531 9.51272 10.1514 9.39044 12.3326 7.54586 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.7833 9.2067 7.14483 9.6667 11.1046 7.9357 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 9.7833 9.2067 7.14483 15.6893 13.8011 8.81059 numMergedOcc 0
16 mol 258 unq 2 iso 0 dist 9.7833 9.16078 5.55495 5.04164 10.9567 9.47519 numMergedOcc 0
17 mol 258 unq 3 iso 0 dist 9.7833 9.16078 5.55495 9.6667 11.1046 5.79537 numMergedOcc 0
18 mol 258 unq 4 iso 0 dist 9.7833 9.16078 5.55495 15.6893 13.8011 9.12006 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 9.60142 9.37845 10.7592 11.9476 10.7806 9.48968 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 9.60142 9.37845 10.7592 5.98252 6.97131 9.64422 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 6.55498 9.82717 5.23192 16.9394 11.9454 7.66291 numMergedOcc 0
22 mol 285 unq 1 iso 0 dist 7.38219 9.82717 9.00041 16.9394 15.7484 7.66291 numMergedOcc 0
