0 mol 11 unq 0 iso 0 dist 7.05626 10.0977 7.98326 11.9259 8.00765 7.46578 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 7.05626 6.5069 7.90478 11.9259 8.00765 7.16561 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 5.87364 4.14436 4.74809 11.5403 9.9801 7.43882 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 5.87364 4.14436 4.74809 10.385 5.64041 7.31198 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 5.87364 9.3714 5.86181 11.5403 9.9801 6.3253 numMergedOcc 0
5 mol 20 unq 3 iso 0 dist 5.87364 9.3714 5.86181 10.385 5.64041 5.80568 numMergedOcc 0
6 mol 20 unq 4 iso 0 dist 6.87419 4.539 4.74809 10.2345 6.05053 5.86181 numMergedOcc 0
7 mol 20 unq 5 iso 0 dist 6.87419 13.6444 7.43882 10.2345 6.05053 6.3253 numMergedOcc 0
8 mol 20 unq 6 iso 0 dist 6.87419 9.41046 7.31198 10.2345 6.05053 5.80568 numMergedOcc 0
9 mol 24 unq 0 iso 0 dist 9.67696 4.89927 8.00171 10.3017 10.3279 5.95834 numMergedOcc 0
10 mol 24 unq 1 iso 0 dist 9.67696 4.89927 8.00171 9.05162 7.88693 4.2121 numMergedOcc 0
11 mol 24 unq 2 iso 0 dist 9.67696 4.89927 8.00171 9.77113 10.2653 6.72323 numMergedOcc 0
12 mol 53 unq 0 iso 0 dist 8.69565 6.40069 8.94227 11.4014 4.45406 8.81982 numMergedOcc 0
13 mol 79 unq 0 iso 0 dist 6.9297 12.6241 9.78384 17.7405 14.8479 8.87742 numMergedOcc 0
14 mol 79 unq 1 iso 0 dist 6.9297 12.6241 9.78384 12.8253 8.25967 4.93468 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.45854 13.0366 9.91054 12.4535 5.74171 9.60622 numMergedOcc 0
16 mol 93 unq 0 iso 0 dist 8.29506 4.41856 8.74378 6.58492 4.37353 8.89417 numMergedOcc 0
17 mol 93 unq 1 iso 0 dist 7.24843 4.39585 8.74378 7.63783 4.37353 8.89417 numMergedOcc 0
18 mol 93 unq 2 iso 0 dist 6.58492 4.41856 8.89417 8.29506 4.37353 8.74378 numMergedOcc 0
19 mol 93 unq 3 iso 0 dist 7.63783 4.39585 8.89417 7.24843 4.37353 8.74378 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 6.41084 11.939 9.83945 11.5467 6.33946 6.75376 numMergedOcc 0
21 mol 141 unq 1 iso 0 dist 6.41084 11.939 9.83945 17.9491 12.8394 9.10042 numMergedOcc 0
22 mol 141 unq 2 iso 0 dist 6.93424 12.0582 6.75376 10.6158 6.33946 9.83945 numMergedOcc 0
23 mol 141 unq 3 iso 0 dist 6.93424 12.0582 6.75376 6.8891 6.59975 9.10042 numMergedOcc 0
24 mol 141 unq 4 iso 0 dist 6.8891 12.0582 9.10042 10.6158 12.8394 9.83945 numMergedOcc 0
25 mol 141 unq 5 iso 0 dist 6.8891 12.0582 9.10042 6.93424 6.59975 6.75376 numMergedOcc 0
26 mol 156 unq 0 iso 0 dist 6.29351 5.57422 5.41575 10.5981 4.40883 8.21184 numMergedOcc 0
27 mol 156 unq 1 iso 0 dist 6.29351 10.4496 6.86566 10.5981 4.40883 5.9976 numMergedOcc 0
28 mol 192 unq 0 iso 0 dist 8.6938 9.81916 8.26288 15.1976 9.52218 6.60053 numMergedOcc 0
29 mol 192 unq 1 iso 0 dist 7.50854 6.8017 8.26288 11.7154 9.52218 6.60053 numMergedOcc 0
30 mol 192 unq 2 iso 0 dist 7.57117 4.13141 6.60053 9.9312 4.20321 9.36796 numMergedOcc 0
31 mol 192 unq 3 iso 0 dist 9.9312 4.13141 9.36796 7.57117 4.20321 6.60053 numMergedOcc 0
32 mol 194 unq 0 iso 0 dist 7.71806 12.1101 6.1886 16.5212 9.4131 6.38324 numMergedOcc 0
33 mol 196 unq 0 iso 0 dist 9.42877 11.3347 7.21349 18.6105 15.4429 9.62455 numMergedOcc 0
34 mol 256 unq 0 iso 0 dist 7.36908 7.49849 4.98734 5.2801 6.48174 6.33496 numMergedOcc 0
35 mol 256 unq 1 iso 0 dist 7.36908 9.92311 6.37963 5.2801 6.48174 6.00636 numMergedOcc 0
36 mol 256 unq 2 iso 0 dist 5.2801 7.49849 6.33496 7.36908 6.48174 4.98734 numMergedOcc 0
37 mol 256 unq 3 iso 0 dist 5.2801 9.92311 6.00636 7.36908 6.48174 6.37963 numMergedOcc 0
