0 mol 13 unq 0 iso 0 dist 7.68531 8.54188 8.5226 12.4916 6.49386 7.71544 10.3134 6.00107 6.54276 4.43066 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.12595 10.6323 8.49525 7.20409 4.1456 9.25641 4.53848 10.7404 14.0111 7.61923 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 9.78763 11.2863 6.22059 11.6737 3.55079 5.96486 14.5186 7.1229 3.71228 5.73799 numMergedOcc 0
3 mol 81 unq 1 iso 0 dist 9.78763 11.2863 6.22059 11.6737 3.55079 5.96486 8.57407 9.36388 7.58448 8.38883 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.12113 5.90092 9.41415 4.90449 6.33908 7.72434 5.74561 10.2834 11.4056 5.90003 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 9.90511 8.89056 8.31873 14.6998 11.846 8.883 12.8512 16.8004 10.2751 9.98509 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 6.07578 7.0159 8.45343 8.30819 12.3288 8.59783 4.61696 10.5988 9.12839 6.51523 numMergedOcc 0
7 mol 219 unq 0 iso 0 dist 9.72263 12.8131 8.72341 13.2981 4.24863 7.13496 9.45086 6.44817 12.6546 9.74779 numMergedOcc 0
8 mol 219 unq 1 iso 0 dist 9.65487 10.1996 8.72341 12.2547 4.24863 7.13496 8.10855 6.44817 12.6546 9.74779 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 9.46077 4.25439 7.03647 9.14778 6.01175 8.99496 7.46055 6.23614 6.04066 9.99149 numMergedOcc 0
10 mol 225 unq 1 iso 0 dist 8.65437 5.21233 7.03647 12.9433 6.01175 8.99496 7.03597 6.23614 6.04066 9.99149 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 8.55542 13.1038 9.58747 17.6456 11.8782 5.43053 21.2979 18.2872 9.31454 9.29745 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 8.93788 13.1038 7.50074 17.6456 11.6181 5.43053 21.2979 13.9966 9.31454 9.29745 numMergedOcc 0
13 mol 292 unq 0 iso 0 dist 5.43095 4.49811 8.25719 10.1584 11.6201 8.35169 11.6413 14.9493 10.0594 5.72473 numMergedOcc 0
14 mol 292 unq 1 iso 0 dist 8.46523 7.24712 8.25719 14.9992 11.6201 8.35169 16.0061 14.9493 10.0594 5.72473 numMergedOcc 0
