0 mol 24 unq 0 iso 0 dist 6.32779 9.67926 6.51016 6.09311 9.74777 11.8553 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.38139 7.77714 5.24524 3.42062 9.07283 9.77004 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 5.12277 6.71884 7.01781 5.32648 6.58179 8.0388 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.61513 9.97224 6.25934 3.30756 8.51839 9.2934 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.22609 7.76044 9.23649 13.469 9.56838 15.7108 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 8.17327 9.18431 14.2451 7.17072 7.09177 14.5218 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 9.52936 9.77304 16.1045 10.0233 7.09177 18.6446 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 5.68841 8.38367 4.53184 7.42165 6.33923 7.36025 numMergedOcc 0
8 mol 111 unq 1 iso 0 dist 5.68841 8.38367 4.53184 7.93667 9.9801 9.60251 numMergedOcc 0
9 mol 111 unq 2 iso 0 dist 5.68841 5.05141 6.48732 7.42165 6.33923 11.3324 numMergedOcc 0
10 mol 111 unq 3 iso 0 dist 5.68841 5.05141 6.48732 7.93667 9.9801 12.6356 numMergedOcc 0
11 mol 111 unq 4 iso 0 dist 5.68841 7.95205 5.25493 3.83194 8.51084 8.48433 numMergedOcc 0
12 mol 111 unq 5 iso 0 dist 5.68841 7.95205 5.25493 5.56913 5.53271 9.30841 numMergedOcc 0
13 mol 124 unq 0 iso 0 dist 7.24083 5.69775 9.35084 11.7364 9.01881 16.0551 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 6.21825 6.02559 5.74134 3.71345 4.67031 7.69241 numMergedOcc 0
15 mol 176 unq 1 iso 0 dist 6.21825 6.02559 5.74134 6.55919 6.20326 10.2079 numMergedOcc 0
16 mol 176 unq 2 iso 0 dist 6.21825 6.02559 5.74134 8.25138 8.98043 7.77962 numMergedOcc 0
17 mol 176 unq 3 iso 0 dist 6.21825 6.02559 5.74134 7.10617 6.8243 8.6431 numMergedOcc 0
18 mol 176 unq 4 iso 0 dist 6.21825 6.02559 5.74134 10.5042 8.90797 11.4266 numMergedOcc 0
19 mol 176 unq 5 iso 0 dist 8.95504 6.02559 6.43713 12.7977 8.00223 9.06564 numMergedOcc 0
20 mol 176 unq 6 iso 0 dist 8.95504 6.02559 6.43713 12.1252 9.60695 10.6536 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 5.52744 9.4588 12.1562 8.73397 7.00382 16.7065 numMergedOcc 0
22 mol 283 unq 0 iso 0 dist 9.74822 5.78449 5.08363 9.8348 7.17276 8.91437 numMergedOcc 0
