0 mol 8 unq 0 iso 0 dist 9.59644 10.0118 5.46588 14.5238 5.95251 8.99126 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 9.04543 6.00428 5.53875 12.6953 5.92411 6.91734 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 7.62107 6.73587 5.53875 10.1794 5.92411 6.91734 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 5.41134 8.85727 8.10708 11.482 7.43198 6.23899 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 8.61357 4.07863 8.10708 9.59244 7.43198 6.23899 numMergedOcc 0
5 mol 59 unq 2 iso 0 dist 9.23605 8.85727 9.20253 11.482 8.34147 6.23899 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 5.73908 3.89794 8.18002 7.51075 13.0823 7.96497 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 6.77421 3.89794 9.01261 7.51075 5.31976 7.96497 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 5.01633 8.91765 8.26819 14.747 12.5382 6.33365 numMergedOcc 0
9 mol 75 unq 1 iso 0 dist 5.01633 8.91765 8.26819 6.95595 5.56574 5.15851 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 5.53726 11.8016 8.24447 10.9783 5.60777 7.96555 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 5.37819 6.68925 6.00131 9.96037 6.09495 8.36431 numMergedOcc 0
12 mol 99 unq 0 iso 0 dist 8.44207 11.0363 9.46619 16.5827 11.4646 7.72108 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 7.22737 9.59696 7.43143 9.96707 5.82598 9.57816 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 5.9962 11.4175 6.61636 19.2505 14.1314 7.92688 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 8.61448 6.2062 6.61636 10.8427 14.1314 7.92688 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 6.7407 10.5012 7.33162 14.1437 7.92818 7.93331 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 6.7407 10.5012 7.33162 12.8143 8.40346 6.98095 numMergedOcc 0
18 mol 173 unq 2 iso 0 dist 6.7407 10.5012 7.33162 17.2257 11.3291 8.31897 numMergedOcc 0
19 mol 187 unq 0 iso 0 dist 5.82577 5.94354 7.9625 9.36086 4.98423 9.27478 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 8.40718 7.96412 9.01377 14.3831 14.7256 9.59333 numMergedOcc 0
21 mol 233 unq 0 iso 0 dist 6.87565 5.19341 5.64376 11.6036 7.92104 9.43203 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 9.29888 8.59287 6.40309 9.01016 7.01206 7.67322 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 9.29888 11.9391 7.87164 19.1949 14.8949 9.68513 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 9.29888 11.9391 7.87164 19.4197 11.2453 9.29858 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 9.33791 6.11645 5.45375 12.9282 6.01492 9.02188 numMergedOcc 0
26 mol 293 unq 0 iso 0 dist 6.97887 4.37303 5.88449 9.55282 5.67215 9.47908 numMergedOcc 0
27 mol 293 unq 1 iso 0 dist 6.97887 4.37303 5.88449 6.27435 11.4201 8.56847 numMergedOcc 0
28 mol 293 unq 2 iso 0 dist 6.97887 11.0749 7.2668 9.55282 5.67215 9.97212 numMergedOcc 0
29 mol 293 unq 3 iso 0 dist 4.66962 4.37303 7.44889 9.55282 8.36783 9.47908 numMergedOcc 0
30 mol 293 unq 4 iso 0 dist 4.66962 4.37303 7.44889 6.27435 9.51167 8.56847 numMergedOcc 0
31 mol 293 unq 5 iso 0 dist 6.04186 4.37303 5.50284 9.55282 6.91752 9.47908 numMergedOcc 0
32 mol 293 unq 6 iso 0 dist 6.04186 4.37303 5.50284 6.27435 5.66805 8.56847 numMergedOcc 0
33 mol 293 unq 7 iso 0 dist 6.04186 11.0749 8.88355 9.55282 6.91752 9.97212 numMergedOcc 0
