0 mol 10 unq 0 iso 0 dist 7.99404 8.44864 8.76488 5.94361 10.5152 5.59965 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.125 6.17217 6.07476 4.29919 11.6989 6.56527 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 6.21423 9.45566 6.30672 4.83412 7.42925 7.48846 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 9.83906 5.51406 11.5684 10.4949 19.5931 8.66165 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.99537 6.37888 7.27534 4.00884 11.4989 5.50508 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 6.61879 7.11127 9.18589 9.3668 11.7281 5.50508 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 7.81131 7.11127 9.58876 9.3668 14.5245 5.50508 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 7.62629 7.4518 10.9752 14.4094 19.6201 8.89417 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 7.62629 7.4518 10.9752 9.73718 17.0964 9.95255 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 6.30128 6.09626 4.6963 6.43704 10.865 7.80873 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.39253 8.4733 13.7956 5.73999 13.5149 7.20249 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 5.28955 8.75431 5.01597 4.09788 6.13508 7.20249 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.3243 9.04845 4.7146 6.26174 11.0798 8.95662 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 8.95239 7.94325 4.7146 5.53181 11.0798 8.95662 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 6.23615 6.72323 4.7146 14.5316 11.0798 8.95662 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 4.96259 6.95568 5.87168 10.453 12.5826 8.86197 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 4.96259 6.95568 5.87168 3.97538 5.67112 5.94379 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 8.10096 7.04477 7.93097 11.378 10.7136 5.70795 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.78928 6.38341 5.06747 7.55971 12.1498 7.16346 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 8.26851 9.11072 16.1916 5.15747 9.67276 6.88827 numMergedOcc 0
20 mol 274 unq 1 iso 0 dist 8.26851 6.83113 10.6481 5.15747 9.67276 9.16942 numMergedOcc 0
21 mol 274 unq 2 iso 0 dist 8.26851 9.44134 16.3797 6.70266 14.0223 7.75216 numMergedOcc 0
22 mol 274 unq 3 iso 0 dist 8.14634 9.11072 14.7933 5.15747 9.02661 6.88827 numMergedOcc 0
23 mol 274 unq 4 iso 0 dist 8.14634 6.83113 7.09841 5.15747 9.02661 9.16942 numMergedOcc 0
24 mol 274 unq 5 iso 0 dist 8.14634 9.44134 13.8495 6.70266 14.0902 7.75216 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 8.34389 8.42076 13.6869 5.89772 13.4263 6.95912 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 8.34389 8.42076 13.6869 5.89772 13.4263 6.95912 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 8.34389 8.42076 13.6869 5.89772 13.4263 6.95912 numMergedOcc 0
