0 mol 15 unq 0 iso 0 dist 6.88546 5.68079 5.69755 16.0228 9.41935 12.5461 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.3964 5.65754 9.63925 5.15474 6.23824 9.67241 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.90581 7.88072 5.6849 5.33828 6.90201 6.64571 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 6.8073 7.49794 13.357 9.54168 6.71313 16.568 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 6.42242 5.43913 10.8889 9.26625 6.54699 14.5851 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 6.42242 8.26877 13.697 9.26625 6.54699 17.0193 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.18097 7.51319 5.22259 16.3019 9.35279 12.998 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 9.18097 8.49887 7.66499 16.3019 9.35279 14.4835 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 8.83135 9.43839 5.22259 13.139 9.35279 12.998 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 7.01545 5.6516 5.46401 7.83204 9.26672 11.3447 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 5.74593 4.91714 3.98877 6.11229 5.77527 8.38104 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 8.02376 4.91714 8.90513 6.11229 7.313 8.38104 numMergedOcc 0
12 mol 92 unq 2 iso 0 dist 6.6186 8.01266 4.15826 4.77825 9.81177 11.2636 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 6.62527 5.78493 7.72948 7.75785 7.87497 10.7723 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 7.37823 5.5223 11.5634 7.51024 9.02735 12.8089 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 7.37823 8.00501 12.3784 7.51024 9.02735 14.8739 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 8.09776 7.56217 12.7379 9.07353 5.67863 13.1481 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 8.09776 9.81055 15.4151 9.07353 5.67863 16.6186 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 5.4455 7.56217 3.7326 9.07353 9.42308 13.1481 numMergedOcc 0
19 mol 194 unq 3 iso 0 dist 5.4455 9.81055 7.29209 9.07353 9.42308 16.6186 numMergedOcc 0
20 mol 194 unq 4 iso 0 dist 6.57575 7.96463 12.8597 6.28486 5.67863 12.0778 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 8.85051 8.01593 6.2222 6.02175 9.05585 11.8842 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 9.38952 7.00616 8.71368 5.5176 8.64557 10.004 numMergedOcc 0
