0 mol 5 unq 0 iso 0 dist 5.14917 7.6976 5.63647 5.43606 7.15734 10.6196 4.34873 6.77563 11.2964 5.32128 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 6.47003 6.98764 6.60126 7.94377 8.92565 12.5759 4.15136 6.76978 10.2951 5.36145 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 9.00234 4.83495 5.9762 5.24518 8.57385 4.32161 6.88024 8.72971 8.99376 8.45559 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 9.00234 5.11803 4.8101 5.24518 8.57385 7.34465 6.88024 8.72971 7.37948 8.45559 numMergedOcc 0
4 mol 171 unq 0 iso 0 dist 6.20851 9.2747 13.1082 14.0871 9.47945 22.351 9.22906 6.01711 17.5872 5.53673 numMergedOcc 0
5 mol 171 unq 1 iso 0 dist 6.20851 8.45343 13.0534 14.0871 9.47945 20.8408 9.22906 6.01711 15.4307 5.53673 numMergedOcc 0
6 mol 175 unq 0 iso 0 dist 7.7013 9.52193 7.64428 14.2738 8.6609 16.0692 12.3666 6.73365 13.3663 6.15969 numMergedOcc 0
7 mol 175 unq 1 iso 0 dist 7.7013 9.52193 7.64428 14.2738 8.6609 16.0692 12.3067 9.45659 14.4011 11.0866 numMergedOcc 0
8 mol 175 unq 2 iso 0 dist 7.7013 9.52193 7.64428 14.2738 8.6609 16.0692 7.28603 9.44856 13.2444 13.5907 numMergedOcc 0
9 mol 175 unq 3 iso 0 dist 7.7013 9.52193 7.64428 8.62822 6.21546 13.3417 12.3666 6.73365 13.3663 5.50014 numMergedOcc 0
10 mol 175 unq 4 iso 0 dist 7.7013 9.52193 7.64428 8.62822 6.21546 13.3417 12.3067 9.45659 14.4011 7.39186 numMergedOcc 0
11 mol 175 unq 5 iso 0 dist 7.7013 9.52193 7.64428 8.62822 6.21546 13.3417 7.28603 9.44856 13.2444 7.05768 numMergedOcc 0
12 mol 175 unq 6 iso 0 dist 7.7013 9.52193 7.64428 7.44933 6.03184 9.25721 12.3666 6.73365 13.3663 7.28617 numMergedOcc 0
13 mol 175 unq 7 iso 0 dist 7.7013 9.52193 7.64428 7.44933 6.03184 9.25721 12.3067 9.45659 14.4011 5.77256 numMergedOcc 0
14 mol 175 unq 8 iso 0 dist 7.7013 9.52193 7.64428 7.44933 6.03184 9.25721 7.28603 9.44856 13.2444 4.96871 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.73634 9.34835 5.65729 8.77448 6.43585 10.9366 8.27755 6.86297 10.3718 5.43796 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 8.55971 8.15287 14.322 5.67196 9.09462 13.7162 5.0241 9.68515 7.68645 8.99881 numMergedOcc 0
17 mol 219 unq 1 iso 0 dist 7.26376 8.15287 5.39853 6.90398 4.67452 6.65093 5.0241 8.09769 7.68645 10.0509 numMergedOcc 0
18 mol 219 unq 2 iso 0 dist 7.26376 8.15287 5.39853 6.90398 4.67452 6.65093 4.36122 7.24832 5.75017 5.48556 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.55805 6.94771 3.96711 12.6024 7.35148 9.57951 15.5892 7.30244 10.433 10.48 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 8.55805 6.94771 3.96711 12.6024 7.35148 9.57951 15.0704 7.29796 9.79808 5.23846 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 6.28023 9.35835 6.50006 5.66978 6.12202 11.537 4.4049 9.81087 11.1891 7.96313 numMergedOcc 0
22 mol 276 unq 0 iso 0 dist 9.5388 6.11207 4.22314 16.342 9.68846 13.3306 10.8564 8.95876 8.75833 13.702 numMergedOcc 0
23 mol 276 unq 1 iso 0 dist 9.5388 6.11207 4.22314 16.342 9.68846 13.3306 12.2055 8.259 10.464 6.21925 numMergedOcc 0
