0 mol 20 unq 0 iso 0 dist 7.61139 6.39663 8.25405 4.8515 7.99756 9.46385 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 8.77624 5.44629 7.4515 10.9354 8.78414 8.45456 numMergedOcc 0
2 mol 63 unq 1 iso 0 dist 8.77624 9.11393 9.76551 10.9354 8.78414 3.4677 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 6.37273 12.1527 8.05514 5.37935 8.19932 13.0221 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.0318 3.51719 5.70907 5.67799 9.21761 5.48763 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 7.99933 10.1703 7.04815 5.56574 6.94594 6.50208 numMergedOcc 0
6 mol 186 unq 1 iso 0 dist 7.99933 10.1703 7.04815 7.76011 5.81881 6.3786 numMergedOcc 0
7 mol 207 unq 0 iso 0 dist 6.06003 9.2787 8.78061 8.77108 7.30153 5.62485 numMergedOcc 0
8 mol 252 unq 0 iso 0 dist 4.54745 12.7164 9.39658 6.40957 7.62991 10.4138 numMergedOcc 0
9 mol 252 unq 1 iso 0 dist 4.54745 12.7164 9.39658 8.56684 9.81261 19.1465 numMergedOcc 0
10 mol 252 unq 2 iso 0 dist 4.54745 7.37634 5.9974 6.40957 7.62991 6.33781 numMergedOcc 0
11 mol 252 unq 3 iso 0 dist 4.54745 7.37634 5.9974 8.56684 9.81261 14.8966 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 7.88296 11.0663 9.65775 13.6008 9.73217 4.05076 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 9.0208 12.6413 8.20485 16.4876 9.83672 5.48178 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 9.30393 12.1716 8.20485 11.7948 9.83672 5.48178 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 9.30058 15.6315 8.94601 9.74601 4.27826 8.03918 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 9.30058 15.6315 8.94601 5.04155 5.82074 11.1127 numMergedOcc 0
17 mol 285 unq 2 iso 0 dist 6.5354 6.6406 8.94601 4.31553 4.27826 8.03918 numMergedOcc 0
18 mol 285 unq 3 iso 0 dist 6.5354 6.6406 8.94601 5.02414 5.82074 11.1127 numMergedOcc 0
