0 mol 19 unq 0 iso 0 dist 8.82056 4.07239 6.00439 10.1092 7.83352 6.20943 5.8625 9.78944 5.14627 8.4674 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.82056 4.07239 6.00439 10.1092 7.83352 6.20943 7.30326 9.56313 4.69858 4.51865 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.82056 4.07239 6.00439 10.0681 10.8007 7.82528 11.3412 15.679 10.4988 7.20519 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.82056 4.07239 6.00439 10.0681 10.8007 7.82528 5.8625 9.78944 5.14627 4.54938 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 8.82056 4.07239 6.00439 10.0681 10.8007 7.82528 7.30326 9.56313 4.69858 6.864 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.04163 11.4785 5.64598 10.7814 7.4697 8.70133 5.78226 8.9232 13.4082 9.38498 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.04163 11.4785 5.64598 10.7814 7.4697 8.70133 16.3165 11.4799 7.41074 9.96396 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 6.04163 11.4785 5.64598 10.7814 7.4697 8.70133 17.9827 16.0453 15.9882 9.75218 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 6.04163 11.4785 5.64598 10.3372 5.7113 4.65521 16.3165 11.4799 7.41074 6.19304 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 8.88953 12.0993 5.64598 16.2272 7.4697 8.70133 13.2702 8.9232 13.4082 9.38498 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 8.88953 12.0993 5.64598 16.2272 7.4697 8.70133 18.3711 11.4799 7.41074 9.96396 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 8.88953 12.0993 5.64598 16.2272 7.4697 8.70133 24.01 16.0453 15.9882 9.75218 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 8.88953 12.0993 5.64598 13.6652 5.7113 4.65521 18.3711 11.4799 7.41074 6.19304 numMergedOcc 0
13 mol 75 unq 0 iso 0 dist 8.96262 4.79472 6.33365 8.64872 9.02771 5.15851 10.4239 11.673 10.0425 7.79912 numMergedOcc 0
14 mol 75 unq 1 iso 0 dist 8.96262 4.79472 6.33365 8.64872 9.02771 5.15851 12.0967 15.657 11.8774 8.56639 numMergedOcc 0
15 mol 75 unq 2 iso 0 dist 8.96262 4.79472 6.33365 8.64872 9.02771 5.15851 9.60759 15.872 10.0372 8.59017 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 5.22628 9.16391 9.66954 11.2519 7.69052 8.66155 17.2604 13.8473 11.3902 7.30858 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 5.22628 9.16391 9.66954 11.2519 7.69052 8.66155 10.0419 9.33865 6.09023 5.83991 numMergedOcc 0
18 mol 115 unq 2 iso 0 dist 5.22628 9.16391 9.66954 11.2519 7.69052 8.66155 6.8104 6.11741 4.61908 7.88312 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 9.61379 5.98813 6.67585 11.7326 4.70378 6.65984 9.57016 8.95269 5.29877 6.57273 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 9.61379 5.98813 6.67585 11.7326 4.70378 6.65984 11.8576 9.99123 6.12232 6.60589 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 6.15754 4.48571 6.25105 8.9413 5.88703 7.85175 12.4455 6.56247 11.216 9.45496 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 6.15754 4.48571 6.25105 8.9413 5.88703 7.85175 14.0876 9.36357 11.4315 6.7625 numMergedOcc 0
23 mol 234 unq 2 iso 0 dist 6.6281 5.91466 6.25105 11.5469 5.88703 7.85175 10.0624 6.56247 11.216 9.45496 numMergedOcc 0
24 mol 234 unq 3 iso 0 dist 6.6281 5.91466 6.25105 11.5469 5.88703 7.85175 13.9869 9.36357 11.4315 6.7625 numMergedOcc 0
25 mol 234 unq 4 iso 0 dist 8.9413 4.48571 7.85175 6.15754 5.88703 6.25105 11.8245 12.9605 10.3337 8.34494 numMergedOcc 0
26 mol 234 unq 5 iso 0 dist 8.9413 4.48571 7.85175 6.15754 5.88703 6.25105 12.4455 9.45496 11.216 6.56247 numMergedOcc 0
27 mol 234 unq 6 iso 0 dist 8.9413 4.48571 7.85175 6.15754 5.88703 6.25105 14.0876 6.7625 11.4315 9.36357 numMergedOcc 0
28 mol 234 unq 7 iso 0 dist 4.91961 11.1927 7.85175 10.2233 5.88703 6.25105 15.5616 12.9605 10.3337 8.34494 numMergedOcc 0
29 mol 234 unq 8 iso 0 dist 4.91961 11.1927 7.85175 10.2233 5.88703 6.25105 11.5103 9.45496 11.216 6.56247 numMergedOcc 0
30 mol 234 unq 9 iso 0 dist 4.91961 11.1927 7.85175 10.2233 5.88703 6.25105 4.98993 6.7625 11.4315 9.36357 numMergedOcc 0
31 mol 235 unq 0 iso 0 dist 8.79626 12.9417 7.32211 20.4877 15.4 9.58736 19.8847 16.4776 9.66021 5.4638 numMergedOcc 0
32 mol 236 unq 0 iso 0 dist 5.99137 4.47231 5.34718 11.0371 7.28249 7.17676 13.7629 9.81562 11.8759 8.03456 numMergedOcc 0
33 mol 236 unq 1 iso 0 dist 5.99137 4.47231 5.34718 11.0371 7.28249 7.17676 13.3575 7.68742 11.3552 6.84306 numMergedOcc 0
34 mol 236 unq 2 iso 0 dist 5.99137 4.47231 5.34718 11.0371 7.28249 7.17676 5.03598 6.27581 6.04825 9.99038 numMergedOcc 0
35 mol 236 unq 3 iso 0 dist 5.99137 4.47231 5.34718 11.0371 7.28249 7.17676 15.1659 13.499 12.6468 9.78037 numMergedOcc 0
36 mol 236 unq 4 iso 0 dist 5.99137 4.47231 5.34718 11.0371 7.28249 7.17676 10.2037 11.2141 6.40312 8.35971 numMergedOcc 0
37 mol 259 unq 0 iso 0 dist 6.20344 12.9748 7.48005 17.2632 12.5353 8.37865 17.5358 12.0576 5.31048 5.30224 numMergedOcc 0
38 mol 282 unq 0 iso 0 dist 7.12228 7.00729 7.32347 10.5849 5.39891 6.85028 4.36798 6.33524 6.3384 8.04483 numMergedOcc 0
