0 mol 1 unq 0 iso 0 dist 7.21511 8.99695 3.41028 5.74563 8.31812 7.73435 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.21511 6.95438 6.04733 5.74563 8.31812 5.71995 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 9.39787 8.39026 14.3419 6.64941 13.4825 5.46988 numMergedOcc 0
3 mol 109 unq 1 iso 0 dist 9.39787 8.39026 14.3419 4.89837 7.04752 9.92553 numMergedOcc 0
4 mol 111 unq 0 iso 0 dist 9.76075 6.90574 12.0896 13.1978 17.2696 8.77841 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 5.27549 8.51585 4.80028 12.7231 9.32166 7.63127 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 5.7306 6.03116 3.44683 8.65195 6.61386 9.14458 numMergedOcc 0
7 mol 163 unq 0 iso 0 dist 5.43385 8.74174 5.57459 12.5106 7.27002 7.3546 numMergedOcc 0
8 mol 237 unq 0 iso 0 dist 9.81108 9.57858 9.59218 8.43171 16.0217 9.53139 numMergedOcc 0
9 mol 237 unq 1 iso 0 dist 9.81108 6.96229 4.83024 10.205 8.32964 7.63812 numMergedOcc 0
10 mol 240 unq 0 iso 0 dist 7.43296 5.46783 9.42043 12.702 18.7356 9.53915 numMergedOcc 0
11 mol 252 unq 0 iso 0 dist 6.38041 9.45457 5.52123 15.7765 12.3574 8.55481 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 9.95473 8.43941 3.42387 5.00301 8.65191 6.47194 numMergedOcc 0
13 mol 260 unq 0 iso 0 dist 6.57555 8.2776 4.933 7.10009 10.2724 8.3149 numMergedOcc 0
