0 mol 59 unq 0 iso 0 dist 6.47132 5.14123 6.08003 6.84869 9.45821 6.23509 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 8.30291 5.48283 5.68906 5.4275 9.81276 7.16844 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.60879 9.35792 5.10993 4.5904 9.58351 9.14801 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 9.61096 7.11218 5.10993 4.63088 9.58351 9.14801 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 7.36475 5.65006 6.77898 5.5308 10.985 5.45099 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 7.36475 5.65006 6.77898 10.5881 12.8435 8.44765 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 7.36475 5.65006 6.77898 9.74852 10.6942 9.06643 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 8.14057 7.15918 6.49362 4.3421 11.3564 7.62463 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 6.91573 9.64785 4.67662 10.5548 8.04118 5.42679 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 7.53748 8.65328 9.87321 4.18108 5.6125 7.0961 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 7.53748 8.65328 9.87321 3.6038 10.3143 8.26768 numMergedOcc 0
11 mol 168 unq 2 iso 0 dist 7.53748 5.69346 5.16335 4.18108 5.6125 6.53038 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 6.82584 9.06892 6.12236 7.61394 11.4364 9.79673 numMergedOcc 0
13 mol 222 unq 1 iso 0 dist 6.82584 9.06892 6.12236 8.54017 10.2723 6.39673 numMergedOcc 0
14 mol 243 unq 0 iso 0 dist 8.19458 7.42359 11.8376 6.56644 14.4361 9.53137 numMergedOcc 0
15 mol 243 unq 1 iso 0 dist 9.45133 7.42359 12.0468 6.56644 14.2282 9.53137 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 6.86014 8.20902 3.97543 9.69757 4.9764 5.13533 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 8.23147 7.98589 4.40029 5.00704 7.42932 5.13533 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 6.49176 7.98589 3.97543 5.00704 4.9764 5.13533 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.02089 8.51266 6.73772 5.92057 9.93746 9.56933 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.87804 8.51266 15.2885 5.92057 10.1744 9.56933 numMergedOcc 0
