0 mol 1 unq 0 iso 0 dist 6.4181 5.06184 6.86701 11.3718 12.7486 7.27254 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.91301 13.8883 9.01112 14.2233 7.17012 8.83742 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 7.20538 7.2452 9.03564 12.0436 10.1082 7.06146 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.04256 7.21365 7.39665 12.2319 15.0902 8.05514 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 7.51075 6.56256 7.39665 13.6654 15.0902 8.05514 numMergedOcc 0
5 mol 74 unq 0 iso 0 dist 9.99155 8.14688 7.93281 5.23115 4.79817 6.3567 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.72689 10.0429 7.80898 14.347 5.31226 8.72458 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 7.74197 11.151 7.80898 8.87924 5.31226 8.72458 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 9.65047 8.55456 9.3948 14.3749 14.484 7.27506 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 5.17585 3.82552 4.22363 10.8508 9.97869 7.34602 numMergedOcc 0
10 mol 112 unq 1 iso 0 dist 7.53905 3.61827 9.05166 10.7968 12.6695 7.44041 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 9.35868 4.57067 6.04595 11.9843 5.61704 8.4965 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 9.15988 13.52 9.57341 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 8.44385 5.92411 6.99446 9.15988 4.99056 9.57341 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 5.63005 5.92411 7.64052 9.15988 3.78311 9.57341 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 8.30654 4.68518 5.40637 10.9428 10.8441 8.68663 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 6.23399 5.18463 8.33439 9.2042 6.55507 9.82982 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.03995 11.8169 7.2793 9.93045 6.87725 8.31881 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 5.96555 6.96644 6.52816 10.9372 5.54129 7.53395 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 7.86368 9.8663 7.81215 9.75169 11.113 9.08151 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 7.36905 3.63202 5.90924 8.28871 4.48907 7.14086 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 6.83408 3.63202 9.58916 8.28871 10.1591 7.14086 numMergedOcc 0
22 mol 267 unq 0 iso 0 dist 9.62043 8.3484 7.34981 13.7004 9.163 7.60505 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 9.6898 18.4042 9.9182 25.8877 16.2289 9.84946 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 5.75596 6.65781 9.9182 13.924 16.2289 9.84946 numMergedOcc 0
25 mol 292 unq 2 iso 0 dist 8.37867 6.65781 9.10788 13.924 8.96137 9.84946 numMergedOcc 0
