0 mol 8 unq 0 iso 0 dist 8.33604 8.53529 11.4716 8.79272 15.8396 7.27018 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 6.85412 9.62394 4.45625 11.0722 10.4906 8.076 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.85412 9.62394 4.45625 14.814 10.3282 6.32226 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 6.33889 9.62394 6.0397 11.0722 9.82483 8.076 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 6.33889 9.62394 6.0397 14.814 9.22214 6.32226 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 9.87449 8.64915 10.9409 14.7278 15.5752 6.59455 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 8.58657 6.41423 5.90856 9.47529 11.2198 6.39966 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 9.75144 7.33768 5.90981 6.00575 8.62284 9.69752 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 9.75144 7.29868 13.719 12.0003 18.3659 4.90592 numMergedOcc 0
9 mol 24 unq 2 iso 0 dist 9.75144 7.29868 13.719 6.00575 8.62284 9.36461 numMergedOcc 0
10 mol 45 unq 0 iso 0 dist 9.43442 9.53378 8.70414 5.46116 12.5773 8.80014 numMergedOcc 0
11 mol 58 unq 0 iso 0 dist 9.58673 8.80614 8.88332 10.4524 12.8203 6.62229 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 8.71128 6.84011 9.23527 11.177 14.5049 9.17466 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 9.5574 6.29233 6.36036 9.71711 14.87 8.56219 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 6.79146 7.88805 6.08911 9.44878 6.82089 9.13191 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 7.66168 7.90048 6.08911 4.28797 6.82089 9.13191 numMergedOcc 0
16 mol 130 unq 2 iso 0 dist 7.66168 9.99802 11.562 4.28797 6.82089 6.95405 numMergedOcc 0
17 mol 130 unq 3 iso 0 dist 9.12581 7.90048 10.0581 4.28797 5.38314 9.13191 numMergedOcc 0
18 mol 130 unq 4 iso 0 dist 9.12581 9.99802 7.20197 4.28797 5.38314 6.95405 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 6.91348 8.70296 9.93183 7.73656 11.0544 6.48674 numMergedOcc 0
20 mol 131 unq 1 iso 0 dist 9.51418 8.70296 16.5048 7.73656 17.216 6.48674 numMergedOcc 0
21 mol 163 unq 0 iso 0 dist 9.19209 9.69121 6.84883 3.89889 5.92747 7.8639 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 9.52634 9.39352 7.60254 4.24624 12.0318 9.71028 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.20046 9.72611 9.87435 5.93488 7.345 7.11785 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 7.13543 9.72611 14.6648 5.93488 9.52987 7.11785 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 6.47873 8.65535 10.7231 6.66155 11.0917 6.37788 numMergedOcc 0
26 mol 194 unq 1 iso 0 dist 6.47873 8.65535 10.7231 5.4499 11.2178 8.7028 numMergedOcc 0
27 mol 209 unq 0 iso 0 dist 7.95911 6.85935 5.50596 4.90038 11.4242 7.97418 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 5.8023 11.7462 6.57921 numMergedOcc 0
29 mol 239 unq 0 iso 0 dist 7.39747 9.01021 5.2908 5.66732 7.18771 5.0804 numMergedOcc 0
30 mol 239 unq 1 iso 0 dist 8.1777 9.01021 5.91881 5.66732 7.94894 5.0804 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 9.19234 9.45514 12.625 8.09454 12.0361 7.79704 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 9.19234 9.45514 12.625 14.1363 13.4562 9.39276 numMergedOcc 0
33 mol 274 unq 2 iso 0 dist 9.19234 6.39866 4.60275 10.4342 12.4553 8.2997 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 6.35287 8.00673 7.83538 6.54009 9.48589 7.21972 numMergedOcc 0
35 mol 284 unq 0 iso 0 dist 8.41504 7.8343 5.39591 6.4399 8.27054 9.63007 numMergedOcc 0
