0 mol 7 unq 0 iso 0 dist 9.04663 4.58682 5.22017 6.70503 8.80762 4.78012 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 8.70353 7.80391 6.59067 11.6619 8.63486 11.5896 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 9.71837 7.55339 8.99661 7.33832 6.61823 5.41023 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 6.98059 13.1521 7.56041 9.83687 5.88354 12.1948 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 6.98059 13.1521 7.56041 11.0059 7.89665 13.2435 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 6.98059 13.1521 7.56041 12.2571 5.39354 5.62353 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 6.98059 13.1521 7.56041 12.0258 5.74854 7.42934 numMergedOcc 0
7 mol 98 unq 4 iso 0 dist 6.98059 13.1521 7.56041 12.8848 8.76566 8.99607 numMergedOcc 0
8 mol 98 unq 5 iso 0 dist 6.98059 13.1521 7.56041 12.3945 8.8368 5.36136 numMergedOcc 0
9 mol 98 unq 6 iso 0 dist 5.63127 6.61449 7.56041 10.6448 5.88354 12.1948 numMergedOcc 0
10 mol 98 unq 7 iso 0 dist 5.63127 6.61449 7.56041 13.4221 7.89665 13.2435 numMergedOcc 0
11 mol 98 unq 8 iso 0 dist 5.63127 6.61449 7.56041 7.96856 5.39354 5.62353 numMergedOcc 0
12 mol 98 unq 9 iso 0 dist 5.63127 6.61449 7.56041 5.58126 5.74854 7.42934 numMergedOcc 0
13 mol 98 unq 10 iso 0 dist 5.63127 6.61449 7.56041 12.7489 8.76566 8.99607 numMergedOcc 0
14 mol 98 unq 11 iso 0 dist 5.63127 6.61449 7.56041 9.77595 8.8368 5.36136 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 6.89591 6.8798 7.77159 10.8466 7.72144 14.466 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 6.23534 10.7719 8.63783 14.9601 9.43259 10.0792 numMergedOcc 0
17 mol 158 unq 0 iso 0 dist 8.65878 16.4777 8.15524 8.17865 7.88319 14.6279 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.13742 10.0275 6.56609 4.69605 6.96521 7.87106 numMergedOcc 0
19 mol 212 unq 0 iso 0 dist 5.90507 5.3488 8.27217 5.19318 8.74585 7.30329 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 8.08402 14.8232 8.45863 4.71355 7.05523 11.4345 numMergedOcc 0
21 mol 214 unq 1 iso 0 dist 8.08402 14.8232 8.45863 15.511 8.46327 7.3913 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 9.74049 6.2868 5.81013 12.8002 9.18895 7.08175 numMergedOcc 0
23 mol 248 unq 0 iso 0 dist 9.68147 5.54969 5.75155 9.56932 6.77954 6.63791 numMergedOcc 0
24 mol 248 unq 1 iso 0 dist 9.61983 10.1262 5.75155 5.93796 6.77954 6.63791 numMergedOcc 0
