0 mol 12 unq 0 iso 0 dist 7.4036 8.79013 5.21734 4.13477 10.451 9.79847 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.34599 7.54282 5.29055 7.53125 8.99751 9.90986 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 6.32127 7.54282 4.76998 7.53125 9.44507 9.90986 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 6.75307 9.21811 10.8132 8.69745 13.5689 6.56549 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 7.24775 9.21811 13.4461 8.69745 14.1556 6.56549 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 9.52676 6.86391 10.5941 11.0716 12.7039 7.61923 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 9.52676 6.86391 10.5941 7.93542 13.31 5.11941 numMergedOcc 0
7 mol 44 unq 2 iso 0 dist 9.52676 6.86391 10.5941 4.61354 10.53 5.84744 numMergedOcc 0
8 mol 44 unq 3 iso 0 dist 9.52676 6.86391 10.5941 6.95649 15.4327 7.7864 numMergedOcc 0
9 mol 46 unq 0 iso 0 dist 6.19084 4.61355 4.07933 11.6888 10.386 7.57749 numMergedOcc 0
10 mol 46 unq 1 iso 0 dist 6.19084 4.61355 4.07933 5.79552 9.27409 8.55202 numMergedOcc 0
11 mol 62 unq 0 iso 0 dist 5.44722 5.92285 5.50712 3.91116 8.85389 7.30651 numMergedOcc 0
12 mol 71 unq 0 iso 0 dist 5.70431 5.21993 5.42064 8.95258 11.6271 9.47964 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 7.43804 7.6935 3.92737 12.6877 8.55509 5.33961 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 7.43804 7.6935 3.92737 11.6464 12.4401 9.29816 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 7.43804 7.6935 3.92737 6.39965 5.94696 5.08983 numMergedOcc 0
16 mol 98 unq 3 iso 0 dist 7.43804 8.71558 3.94967 16.3787 10.9995 8.3505 numMergedOcc 0
17 mol 128 unq 0 iso 0 dist 8.87326 7.56557 8.16095 6.53948 10.733 8.83385 numMergedOcc 0
18 mol 128 unq 1 iso 0 dist 8.87326 4.93016 5.53655 8.76554 8.87314 9.67042 numMergedOcc 0
19 mol 128 unq 2 iso 0 dist 8.87326 4.93016 5.53655 6.56049 10.2256 9.01072 numMergedOcc 0
20 mol 128 unq 3 iso 0 dist 8.87326 4.93016 5.53655 6.53948 10.733 7.11781 numMergedOcc 0
21 mol 128 unq 4 iso 0 dist 8.87326 4.93016 5.53655 5.92897 9.38436 8.77539 numMergedOcc 0
22 mol 148 unq 0 iso 0 dist 9.92375 9.8506 5.62734 11.6478 12.893 7.55497 numMergedOcc 0
23 mol 167 unq 0 iso 0 dist 7.93807 9.38297 5.95858 10.33 9.14629 6.48993 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 8.03226 9.97859 13.8857 6.89134 12.8915 6.96382 numMergedOcc 0
