0 mol 0 unq 0 iso 0 dist 8.82102 9.66691 6.80481 4.87624 7.65806 10.7838 8.21826 9.67081 14.3883 8.29174 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.87871 9.45239 9.36867 8.95909 9.24927 16.5571 15.1968 9.99939 10.8657 19.1023 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 9.56737 8.63912 5.6823 11.5882 6.35756 10.2845 13.6875 7.17488 12.5877 4.59417 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 7.83619 8.15289 10.4339 10.0837 9.28393 17.041 4.81304 5.92733 11.8427 6.00473 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 9.10619 8.78112 4.84714 9.66339 8.56324 8.9192 17.3816 9.00072 12.4493 12.2243 numMergedOcc 0
5 mol 152 unq 1 iso 0 dist 9.10619 8.78112 4.84714 13.9994 6.70283 9.27706 17.3816 9.00072 12.4493 4.73288 numMergedOcc 0
6 mol 152 unq 2 iso 0 dist 9.10619 8.78112 4.84714 14.2552 7.16148 11.6735 17.3816 9.00072 12.4493 4.70284 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 9.00898 8.87876 5.57734 5.96451 9.29945 10.8463 10.8953 9.19156 12.1276 13.8965 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 8.0974 7.97 9.4452 12.2822 6.69288 12.0355 12.4011 4.72821 13.1149 4.69387 numMergedOcc 0
9 mol 178 unq 1 iso 0 dist 8.0974 7.97 9.4452 12.4338 6.43573 14.9034 12.4011 4.72821 13.1149 3.70233 numMergedOcc 0
10 mol 178 unq 2 iso 0 dist 8.0974 7.97 9.4452 13.9722 7.17202 14.659 12.4011 4.72821 13.1149 7.39705 numMergedOcc 0
11 mol 178 unq 3 iso 0 dist 8.0974 7.97 9.4452 13.5599 8.81551 16.8397 12.4011 4.72821 13.1149 9.77268 numMergedOcc 0
12 mol 178 unq 4 iso 0 dist 8.0974 6.95432 6.42973 12.2822 6.69288 7.06025 12.4011 4.72821 9.15383 4.69387 numMergedOcc 0
13 mol 178 unq 5 iso 0 dist 8.0974 6.95432 6.42973 12.4338 6.43573 10.0638 12.4011 4.72821 9.15383 3.70233 numMergedOcc 0
14 mol 178 unq 6 iso 0 dist 8.0974 6.95432 6.42973 13.9722 7.17202 13.2692 12.4011 4.72821 9.15383 7.39705 numMergedOcc 0
15 mol 178 unq 7 iso 0 dist 8.0974 6.95432 6.42973 13.5599 8.81551 15.0672 12.4011 4.72821 9.15383 9.77268 numMergedOcc 0
16 mol 178 unq 8 iso 0 dist 8.0974 9.32853 10.8373 12.2822 6.69288 15.7548 12.4011 4.72821 15.0797 4.69387 numMergedOcc 0
17 mol 178 unq 9 iso 0 dist 8.0974 9.32853 10.8373 12.4338 6.43573 17.2277 12.4011 4.72821 15.0797 3.70233 numMergedOcc 0
18 mol 178 unq 10 iso 0 dist 8.0974 9.32853 10.8373 13.9722 7.17202 13.544 12.4011 4.72821 15.0797 7.39705 numMergedOcc 0
19 mol 178 unq 11 iso 0 dist 8.0974 9.32853 10.8373 13.5599 8.81551 15.2622 12.4011 4.72821 15.0797 9.77268 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 9.67457 9.11574 13.1851 5.82028 6.18308 10.8156 8.81074 6.85824 15.1051 4.29623 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 6.37342 7.69491 10.6736 5.29737 6.16342 6.73665 7.72768 4.43499 10.5638 4.32238 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 6.90434 8.18813 3.97543 13.2927 9.7748 12.1398 11.5613 4.9764 5.13533 11.8607 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 6.90434 8.18813 3.97543 13.2927 9.7748 12.1398 13.0566 6.36559 8.0969 10.9137 numMergedOcc 0
