0 mol 5 unq 0 iso 0 dist 9.68326 9.08586 7.44029 5.39051 4.98321 6.38154 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.18111 8.83912 7.44029 7.44679 4.98321 6.38154 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.23015 4.93826 5.77745 8.97282 8.07318 5.23233 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 9.23015 4.93826 5.77745 4.54526 7.44277 6.29702 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 8.3224 6.21952 5.14358 10.0107 7.27243 4.61651 numMergedOcc 0
5 mol 30 unq 1 iso 0 dist 8.3224 6.21952 5.14358 8.43217 8.23784 5.34619 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.91019 11.8317 9.762 13.2897 8.46627 10.8441 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 5.91019 11.8317 9.762 14.1134 9.22208 15.2203 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 6.99586 6.13489 9.68629 10.4961 9.99441 5.92795 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 6.62354 6.24804 9.46621 7.53887 9.09348 9.78374 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 6.62354 9.97562 9.94704 7.53887 9.09348 8.08642 numMergedOcc 0
11 mol 109 unq 2 iso 0 dist 8.00085 14.8896 9.46621 7.83378 9.09348 9.78374 numMergedOcc 0
12 mol 109 unq 3 iso 0 dist 8.00085 13.5611 9.94704 7.83378 9.09348 8.08642 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 6.14652 13.5949 8.78303 11.6261 8.62504 4.63732 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 8.09403 3.76321 8.27396 8.04827 4.61596 6.60692 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 8.13526 5.09497 6.90791 4.94644 6.69042 5.37149 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.36144 8.60571 8.79378 10.9033 9.95026 9.39446 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 9.36144 8.60571 8.79378 11.622 9.09594 6.98142 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 6.0751 3.73772 5.76164 6.49444 9.01338 4.98419 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 5.9625 5.05085 9.94117 4.51728 8.93212 5.45156 numMergedOcc 0
