0 mol 15 unq 0 iso 0 dist 9.70735 9.40358 9.97507 5.9024 8.28153 6.49982 15.2545 9.03536 8.38064 11.7793 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 6.1032 7.39848 9.86609 10.615 8.13395 6.20293 11.4251 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 6.68311 15.0607 9.96708 4.61081 4.86198 10.7434 10.1663 8.24309 9.78528 6.62699 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.16299 10.3774 8.70481 11.3918 7.37171 15.1432 11.0108 14.9342 9.96396 21.1182 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.16299 10.3774 8.70481 11.3918 7.37171 15.1432 10.9082 13.3558 6.19304 19.3924 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.27015 12.6626 8.70481 6.29235 7.37171 15.1432 20.562 14.9342 9.96396 21.1182 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 8.27015 12.6626 8.70481 6.29235 7.37171 15.1432 17.327 13.3558 6.19304 19.3924 numMergedOcc 0
7 mol 75 unq 0 iso 0 dist 8.2147 13.5815 7.79912 11.7519 9.16597 4.74027 13.0332 5.64643 8.56639 11.7473 numMergedOcc 0
8 mol 75 unq 1 iso 0 dist 8.2147 13.5815 7.79912 11.7519 9.16597 4.74027 18.603 10.4899 8.59017 13.2779 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 8.46684 5.14332 6.90986 8.51521 5.93278 6.34182 9.47822 10.498 7.11972 12.8676 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 8.46684 5.14332 6.90986 11.3635 6.19918 8.66957 9.47822 10.498 7.11972 14.3131 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 8.99949 11.3502 6.85062 7.51072 8.80895 11.6692 18.591 10.7062 8.40312 17.775 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.99949 11.3502 6.85062 7.51072 8.80895 11.6692 15.0798 6.63273 7.12972 12.9064 numMergedOcc 0
13 mol 142 unq 0 iso 0 dist 7.15087 8.68855 9.2313 5.19808 8.04118 4.05822 10.5719 5.50998 7.73169 8.39035 numMergedOcc 0
14 mol 142 unq 1 iso 0 dist 7.15087 8.68855 9.2313 5.19808 8.04118 4.05822 15.3413 11.1395 8.96657 11.6454 numMergedOcc 0
15 mol 142 unq 2 iso 0 dist 7.15087 5.50176 5.31024 5.19808 8.04118 4.7832 10.5719 5.50998 7.26382 8.39035 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 8.62303 7.13783 13.3822 12.9169 7.38516 6.03031 13.3708 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 6.15806 10.6362 7.26832 8.62303 7.13783 13.3822 17.5925 13.8543 7.80463 20.4298 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 7.26981 10.8952 8.31064 13.6897 9.19385 6.0222 13.2486 8.02948 6.73034 9.1927 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 7.26981 10.8952 8.31064 5.17707 7.14243 6.93212 13.2486 8.02948 6.73034 9.60694 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 7.26981 10.8952 8.31064 6.10294 5.77511 10.2118 13.2486 8.02948 6.73034 9.27311 numMergedOcc 0
21 mol 253 unq 3 iso 0 dist 7.26981 10.8952 8.31064 5.04216 7.81382 12.4811 13.2486 8.02948 6.73034 12.3519 numMergedOcc 0
22 mol 253 unq 4 iso 0 dist 9.02643 8.25257 8.31064 13.5912 9.19385 6.0222 8.68368 8.02948 6.73034 9.1927 numMergedOcc 0
23 mol 253 unq 5 iso 0 dist 9.02643 8.25257 8.31064 3.99655 7.14243 6.93212 8.68368 8.02948 6.73034 9.60694 numMergedOcc 0
24 mol 253 unq 6 iso 0 dist 9.02643 8.25257 8.31064 5.37143 5.77511 10.2118 8.68368 8.02948 6.73034 9.27311 numMergedOcc 0
25 mol 253 unq 7 iso 0 dist 9.02643 8.25257 8.31064 6.92436 7.81382 12.4811 8.68368 8.02948 6.73034 12.3519 numMergedOcc 0
26 mol 253 unq 8 iso 0 dist 8.68368 8.25257 6.73034 15.6704 8.94786 8.57513 9.02643 8.02948 8.31064 13.723 numMergedOcc 0
27 mol 253 unq 9 iso 0 dist 8.68368 8.25257 6.73034 13.5912 9.1927 6.0222 9.02643 8.02948 8.31064 9.19385 numMergedOcc 0
28 mol 253 unq 10 iso 0 dist 8.68368 8.25257 6.73034 3.99655 9.60694 6.93212 9.02643 8.02948 8.31064 7.14243 numMergedOcc 0
29 mol 253 unq 11 iso 0 dist 8.68368 8.25257 6.73034 5.37143 9.27311 10.2118 9.02643 8.02948 8.31064 5.77511 numMergedOcc 0
