0 mol 4 unq 0 iso 0 dist 9.80438 13.5907 6.3317 7.00063 9.25752 10.0267 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.84963 11.5622 4.75533 8.37026 9.05556 9.11628 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.56859 14.8167 7.17133 16.4573 7.41719 4.02596 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 9.56859 14.8167 7.17133 15.491 8.93237 12.6601 numMergedOcc 0
4 mol 69 unq 2 iso 0 dist 5.75135 12.8471 7.17133 12.8766 7.41719 4.02596 numMergedOcc 0
5 mol 69 unq 3 iso 0 dist 5.75135 12.8471 7.17133 10.5183 8.93237 12.6601 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 9.94528 9.39588 7.69755 12.7931 9.55089 10.7694 numMergedOcc 0
7 mol 83 unq 1 iso 0 dist 9.94528 14.6472 9.64197 12.7931 9.55089 10.9198 numMergedOcc 0
8 mol 83 unq 2 iso 0 dist 8.94777 12.0034 7.69755 15.2924 9.55089 10.7694 numMergedOcc 0
9 mol 83 unq 3 iso 0 dist 8.94777 16.6651 9.64197 15.2924 9.55089 10.9198 numMergedOcc 0
10 mol 83 unq 4 iso 0 dist 9.47551 5.68174 7.69755 6.45031 9.55089 10.7694 numMergedOcc 0
11 mol 83 unq 5 iso 0 dist 9.47551 6.90476 9.64197 6.45031 9.55089 10.9198 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 8.23055 6.56343 6.34669 8.39416 9.22123 7.30364 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 8.30746 9.1793 6.34669 10.4946 9.22123 7.30364 numMergedOcc 0
14 mol 93 unq 0 iso 0 dist 6.58814 8.97237 7.44027 12.7865 9.15802 5.40647 numMergedOcc 0
15 mol 120 unq 0 iso 0 dist 8.83822 14.5868 7.50959 13.9931 7.78914 5.47516 numMergedOcc 0
16 mol 120 unq 1 iso 0 dist 8.83822 14.5868 7.50959 7.26787 9.35938 11.9801 numMergedOcc 0
17 mol 120 unq 2 iso 0 dist 8.83822 4.15475 5.24948 13.9931 7.78914 11.0725 numMergedOcc 0
18 mol 120 unq 3 iso 0 dist 8.83822 4.15475 5.24948 7.26787 9.35938 5.42805 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 4.82356 8.75242 9.35049 4.58564 6.30568 7.72261 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 8.22722 13.3296 6.67937 13.9116 9.88156 5.16554 numMergedOcc 0
21 mol 133 unq 2 iso 0 dist 8.52036 6.49614 6.67937 4.70999 9.88156 5.16554 numMergedOcc 0
22 mol 133 unq 3 iso 0 dist 8.83476 6.45333 9.35049 9.97131 6.30568 7.72261 numMergedOcc 0
23 mol 183 unq 0 iso 0 dist 5.50896 6.11741 7.80268 7.93856 4.77438 6.08414 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 9.09568 5.54706 5.83039 11.667 9.70628 8.16645 numMergedOcc 0
25 mol 254 unq 1 iso 0 dist 9.99168 5.54706 6.74364 11.667 7.98511 8.16645 numMergedOcc 0
26 mol 254 unq 2 iso 0 dist 7.84221 8.87361 5.83039 15.4665 9.70628 8.16645 numMergedOcc 0
27 mol 254 unq 3 iso 0 dist 9.67383 8.87361 6.74364 15.4665 7.98511 8.16645 numMergedOcc 0
28 mol 257 unq 0 iso 0 dist 9.82105 15.5338 8.23073 13.0082 9.62817 8.93071 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 6.61322 9.26732 5.94328 11.6457 9.33223 5.52381 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 6.61322 6.72414 7.91978 11.6457 9.33223 6.0296 numMergedOcc 0
31 mol 260 unq 0 iso 0 dist 9.46576 13.9264 6.90472 14.8362 7.30584 10.4884 numMergedOcc 0
32 mol 287 unq 0 iso 0 dist 6.16127 5.66584 9.31611 7.51649 9.7875 4.38561 numMergedOcc 0
33 mol 287 unq 1 iso 0 dist 6.16127 5.27724 6.25845 7.51649 9.7875 10.9625 numMergedOcc 0
34 mol 288 unq 0 iso 0 dist 6.16127 5.66584 9.31611 7.51649 9.7875 4.38561 numMergedOcc 0
35 mol 288 unq 1 iso 0 dist 6.16127 5.27724 6.25845 7.51649 9.7875 10.9625 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 6.16127 5.66584 9.31611 7.51649 9.7875 4.38561 numMergedOcc 0
37 mol 289 unq 1 iso 0 dist 6.16127 5.27724 6.25845 7.51649 9.7875 10.9625 numMergedOcc 0
