0 mol 21 unq 0 iso 0 dist 6.97295 8.33265 10.4247 4.81505 8.07914 13.0991 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.49678 6.17165 6.47086 5.37112 5.06188 8.5859 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.52544 9.39338 12.6371 4.77004 5.73235 12.7637 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.52544 8.9053 13.4778 4.77004 5.73235 13.4333 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 8.08674 9.39338 17.2592 4.77004 7.48127 12.7637 numMergedOcc 0
5 mol 76 unq 3 iso 0 dist 8.08674 8.9053 15.1961 4.77004 7.48127 13.4333 numMergedOcc 0
6 mol 94 unq 0 iso 0 dist 8.93438 8.92072 5.24903 5.54718 9.25496 8.2128 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 5.90675 6.00241 6.43211 9.40832 8.03869 13.5823 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 7.88328 6.00571 11.1968 7.4328 7.93793 13.3246 numMergedOcc 0
9 mol 132 unq 0 iso 0 dist 8.97036 9.4827 15.7512 12.389 6.94745 18.1337 numMergedOcc 0
10 mol 132 unq 1 iso 0 dist 8.97036 9.0788 5.6296 12.389 6.94745 10.1299 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 8.66519 6.8754 11.0283 16.2743 8.72323 19.6774 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 8.35731 9.08545 11.0283 15.4709 8.72323 19.6774 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 6.73513 9.00763 6.89035 7.90201 4.81837 5.8325 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 6.73513 9.00763 6.89035 11.9426 6.43519 12.7548 numMergedOcc 0
15 mol 211 unq 0 iso 0 dist 7.49132 7.03051 6.09386 11.2256 8.10779 12.9039 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 7.73969 5.50501 10.1358 11.1044 4.71683 13.6596 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 7.04478 9.28634 6.54029 8.30658 9.01071 8.45305 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 7.04478 9.28634 6.54029 11.481 8.86185 8.99865 numMergedOcc 0
19 mol 239 unq 2 iso 0 dist 8.4319 6.35005 10.6145 10.3585 7.58554 11.2673 numMergedOcc 0
20 mol 239 unq 3 iso 0 dist 8.4319 6.97325 8.52005 10.3585 7.58554 13.0427 numMergedOcc 0
21 mol 239 unq 4 iso 0 dist 8.4319 6.36178 12.0215 10.3585 7.58554 15.8656 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 5.91549 6.45323 8.16645 8.1834 9.54511 8.77315 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 9.27225 9.41308 7.74421 11.1283 8.58092 9.97026 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 5.50553 8.94629 11.8626 11.0096 9.8165 19.8929 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 8.78501 9.62474 15.1918 8.96584 9.39714 7.96955 numMergedOcc 0
26 mol 266 unq 1 iso 0 dist 8.78501 8.01441 12.2663 8.96584 9.39714 16.4712 numMergedOcc 0
27 mol 281 unq 0 iso 0 dist 5.53313 9.29634 6.32828 4.48742 7.65321 12.1576 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 8.92737 7.64578 10.5231 9.82894 6.37998 10.3143 numMergedOcc 0
29 mol 294 unq 1 iso 0 dist 8.92737 6.28096 13.1133 9.82894 6.37998 15.7563 numMergedOcc 0
30 mol 294 unq 2 iso 0 dist 7.15278 5.85292 10.5231 6.49126 6.37998 10.3143 numMergedOcc 0
