0 mol 8 unq 0 iso 0 dist 8.76702 4.11115 8.89145 8.37509 5.7343 9.00925 11.382 13.2274 8.68949 16.2669 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.27477 4.11115 6.92865 8.37509 11.3728 9.00925 11.382 8.33226 8.68949 16.2669 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 8.48453 5.21083 6.53817 12.1881 11.7814 9.26685 10.5316 10.1064 9.5937 5.4483 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 8.48453 5.21083 6.53817 12.1881 11.7814 9.26685 7.96836 13.5023 7.34681 9.4204 numMergedOcc 0
4 mol 17 unq 2 iso 0 dist 8.80499 5.21083 9.81769 12.1881 14.8418 9.26685 10.5316 11.3627 9.5937 5.4483 numMergedOcc 0
5 mol 17 unq 3 iso 0 dist 8.80499 5.21083 9.81769 12.1881 14.8418 9.26685 7.96836 15.703 7.34681 9.4204 numMergedOcc 0
6 mol 42 unq 0 iso 0 dist 7.06199 10.2834 8.52254 13.2867 6.73507 8.84148 9.50568 4.38082 5.52834 5.21506 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 7.65229 11.4776 5.81552 13.0796 9.60908 9.42175 9.93751 6.29923 9.42014 5.44978 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 4.93984 4.72853 8.58946 12.6803 13.1346 9.82329 6.26373 4.70374 7.20545 9.97915 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 6.96824 13.2658 9.63295 10.7353 5.16386 6.47689 16.1051 9.40823 8.92801 7.11585 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 6.96824 13.2658 9.63295 10.7353 5.16386 6.47689 7.21606 5.32364 9.40718 5.15002 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.96424 4.36623 7.30244 7.03223 10.48 7.35148 10.4047 12.2765 6.39087 11.4142 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 5.40366 4.36623 7.29796 7.03223 5.23846 7.35148 10.4047 13.2427 6.39087 11.4142 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 8.62971 7.14491 6.40592 8.99792 4.86437 9.174 13.6984 7.3737 7.26758 10.9643 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 7.7309 11.0146 9.43169 10.703 8.80293 6.41477 14.5563 7.78464 8.88741 10.1876 numMergedOcc 0
15 mol 276 unq 0 iso 0 dist 6.24808 7.74891 8.95876 16.2114 13.702 9.68846 14.6188 11.5806 9.87655 4.97223 numMergedOcc 0
