0 mol 24 unq 0 iso 0 dist 6.60423 5.39241 8.62284 4.32034 9.69752 5.90981 8.52463 9.36461 13.719 10.2653 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 6.60423 5.39241 8.62284 8.52463 9.36461 13.719 4.32034 9.69752 5.90981 10.2653 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.83786 4.51549 8.62284 9.6469 9.69752 5.90981 14.6654 9.36461 13.719 10.2653 numMergedOcc 0
3 mol 24 unq 1 iso 1 dist 7.83786 4.51549 8.62284 14.6654 9.36461 13.719 9.6469 9.69752 5.90981 10.2653 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.52117 5.87283 9.17518 4.55437 7.03307 9.05795 6.16231 7.25707 6.37181 5.25016 numMergedOcc 0
5 mol 44 unq 0 iso 1 dist 7.52117 5.87283 9.17518 6.16231 7.25707 6.37181 4.55437 7.03307 9.05795 5.25016 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 7.52117 10.6223 8.21833 4.55437 7.03307 11.814 6.16231 7.25707 7.77924 5.25016 numMergedOcc 0
7 mol 44 unq 1 iso 1 dist 7.52117 10.6223 8.21833 6.16231 7.25707 7.77924 4.55437 7.03307 11.814 5.25016 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 8.65802 12.3813 9.20197 13.534 8.57827 10.7055 5.83515 7.94453 6.91947 11.7781 numMergedOcc 0
9 mol 92 unq 0 iso 1 dist 8.65802 12.3813 9.20197 5.83515 7.94453 6.91947 13.534 8.57827 10.7055 11.7781 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 9.28592 10.3933 6.82089 8.01932 9.13191 6.08911 6.75397 6.95405 11.562 12.2217 numMergedOcc 0
11 mol 130 unq 0 iso 1 dist 9.28592 10.3933 6.82089 6.75397 6.95405 11.562 8.01932 9.13191 6.08911 12.2217 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 9.28592 9.16988 5.38314 8.01932 9.13191 10.0581 6.75397 6.95405 7.20197 12.2217 numMergedOcc 0
13 mol 130 unq 1 iso 1 dist 9.28592 9.16988 5.38314 6.75397 6.95405 7.20197 8.01932 9.13191 10.0581 12.2217 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 9.15431 7.71288 9.39683 6.51918 5.44303 10.8622 9.60968 8.50562 12.6448 5.37172 numMergedOcc 0
15 mol 131 unq 0 iso 1 dist 9.15431 7.71288 9.39683 9.60968 8.50562 12.6448 6.51918 5.44303 10.8622 5.37172 numMergedOcc 0
16 mol 131 unq 1 iso 0 dist 6.92648 4.89973 9.39683 7.92788 5.44303 10.8622 8.23791 8.50562 12.6448 5.37172 numMergedOcc 0
17 mol 131 unq 1 iso 1 dist 6.92648 4.89973 9.39683 8.23791 8.50562 12.6448 7.92788 5.44303 10.8622 5.37172 numMergedOcc 0
18 mol 131 unq 2 iso 0 dist 9.29384 7.00551 9.39683 13.1439 5.44303 10.8622 13.7237 8.50562 12.6448 5.37172 numMergedOcc 0
19 mol 131 unq 2 iso 1 dist 9.29384 7.00551 9.39683 13.7237 8.50562 12.6448 13.1439 5.44303 10.8622 5.37172 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 7.88319 6.63727 6.39981 6.4079 6.76055 5.42969 4.25067 9.36343 4.77562 6.97949 numMergedOcc 0
21 mol 158 unq 0 iso 1 dist 7.88319 6.63727 6.39981 4.25067 9.36343 4.77562 6.4079 6.76055 5.42969 6.97949 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 7.35824 11.1651 7.01126 11.8693 5.89564 4.30489 6.77832 5.60528 4.57622 6.75531 numMergedOcc 0
23 mol 175 unq 0 iso 1 dist 7.35824 11.1651 7.01126 6.77832 5.60528 4.57622 11.8693 5.89564 4.30489 6.75531 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 9.83476 13.1933 7.94153 10.5063 4.5271 4.35079 14.4429 7.02575 5.34643 6.68665 numMergedOcc 0
25 mol 186 unq 0 iso 1 dist 9.83476 13.1933 7.94153 14.4429 7.02575 5.34643 10.5063 4.5271 4.35079 6.68665 numMergedOcc 0
26 mol 210 unq 0 iso 0 dist 7.63018 10.9823 6.4829 5.85636 5.57779 5.96222 10.0337 7.05649 10.1011 7.33239 numMergedOcc 0
27 mol 210 unq 0 iso 1 dist 7.63018 10.9823 6.4829 10.0337 7.05649 10.1011 5.85636 5.57779 5.96222 7.33239 numMergedOcc 0
28 mol 210 unq 1 iso 0 dist 7.63018 10.9823 6.4829 5.85636 5.57779 5.96222 7.67559 6.78579 12.5026 8.67862 numMergedOcc 0
29 mol 210 unq 1 iso 1 dist 7.63018 10.9823 6.4829 7.67559 6.78579 12.5026 5.85636 5.57779 5.96222 8.67862 numMergedOcc 0
30 mol 210 unq 1 iso 0 dist 7.63018 10.9823 6.4829 10.0337 7.05649 10.1011 7.67559 6.78579 12.5026 5.72053 numMergedOcc 0
31 mol 210 unq 1 iso 1 dist 7.63018 10.9823 6.4829 7.67559 6.78579 12.5026 10.0337 7.05649 10.1011 5.72053 numMergedOcc 0
32 mol 225 unq 0 iso 0 dist 8.87609 5.06326 7.29542 5.76292 9.23935 9.51752 8.21235 7.77552 10.9596 4.23863 numMergedOcc 0
33 mol 225 unq 0 iso 1 dist 8.87609 5.06326 7.29542 8.21235 7.77552 10.9596 5.76292 9.23935 9.51752 4.23863 numMergedOcc 0
34 mol 282 unq 0 iso 0 dist 5.23193 7.30164 9.96468 7.55098 8.53065 6.18986 6.46616 8.67489 9.09482 12.6015 numMergedOcc 0
35 mol 282 unq 0 iso 1 dist 5.23193 7.30164 9.96468 6.46616 8.67489 9.09482 7.55098 8.53065 6.18986 12.6015 numMergedOcc 0
36 mol 282 unq 1 iso 0 dist 5.23193 8.36249 9.59817 7.55098 8.53065 10.2999 6.46616 8.67489 6.21176 12.6015 numMergedOcc 0
37 mol 282 unq 1 iso 1 dist 5.23193 8.36249 9.59817 6.46616 8.67489 6.21176 7.55098 8.53065 10.2999 12.6015 numMergedOcc 0
