0 mol 19 unq 0 iso 0 dist 8.18518 6.57145 4.54938 10.7917 7.34551 7.20519 12.9091 5.80928 6.864 7.07775 10.4026 10.9543 8.78293 5.31524 11.4401 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 10.7917 7.34551 7.20519 7.07775 10.4026 10.9543 8.78293 11.4401 5.31524 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 8.18518 6.57145 4.54938 10.7917 7.34551 7.20519 12.9091 5.80928 6.864 7.07775 5.36258 6.55187 8.23643 11.0832 12.3093 numMergedOcc 0
3 mol 19 unq 1 iso 1 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 10.7917 7.34551 7.20519 7.07775 5.36258 6.55187 8.23643 12.3093 11.0832 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 8.18518 6.57145 4.54938 10.7917 7.34551 7.20519 12.9091 5.80928 6.864 7.07775 12.7832 5.14627 7.82528 10.4988 4.69858 numMergedOcc 0
5 mol 19 unq 2 iso 1 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 10.7917 7.34551 7.20519 7.07775 12.7832 5.14627 7.82528 4.69858 10.4988 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 11.6681 5.64643 8.56639 13.9013 10.4899 8.59017 7.00674 7.14313 10.0425 5.15851 11.8774 10.0372 numMergedOcc 0
7 mol 75 unq 0 iso 1 dist 7.16583 6.77761 7.79912 13.9013 10.4899 8.59017 11.6681 5.64643 8.56639 7.00674 7.14313 10.0425 5.15851 10.0372 11.8774 numMergedOcc 0
8 mol 75 unq 1 iso 0 dist 7.118 5.06305 7.79912 8.24814 5.64643 8.56639 11.548 10.4899 8.59017 7.00674 9.77241 10.0425 5.15851 11.8774 10.0372 numMergedOcc 0
9 mol 75 unq 1 iso 1 dist 7.118 5.06305 7.79912 11.548 10.4899 8.59017 8.24814 5.64643 8.56639 7.00674 9.77241 10.0425 5.15851 10.0372 11.8774 numMergedOcc 0
10 mol 75 unq 2 iso 0 dist 8.24814 5.06305 8.56639 7.118 5.64643 7.79912 11.548 7.00674 8.59017 10.4899 9.77241 11.8774 5.15851 10.0425 10.0372 numMergedOcc 0
11 mol 75 unq 2 iso 1 dist 8.24814 5.06305 8.56639 11.548 7.00674 8.59017 7.118 5.64643 7.79912 10.4899 9.77241 11.8774 5.15851 10.0372 10.0425 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 15.6218 9.71151 8.86688 10.1407 6.0026 7.2495 8.72704 10.1589 15.9331 numMergedOcc 0
13 mol 100 unq 0 iso 1 dist 9.57498 6.89762 6.45675 15.6218 9.71151 8.86688 10.0165 5.33144 7.47343 10.1407 6.0026 7.2495 8.72704 15.9331 10.1589 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 7.44784 7.64822 7.30858 12.7842 10.8507 5.83991 9.56867 11.5723 7.88312 8.02349 12.3154 11.3902 8.66155 6.09023 4.61908 numMergedOcc 0
15 mol 115 unq 0 iso 1 dist 7.44784 7.64822 7.30858 9.56867 11.5723 7.88312 12.7842 10.8507 5.83991 8.02349 12.3154 11.3902 8.66155 4.61908 6.09023 numMergedOcc 0
16 mol 115 unq 1 iso 0 dist 9.56867 7.64822 7.88312 7.44784 11.5723 7.30858 12.7842 8.02349 5.83991 10.8507 12.3154 4.61908 8.66155 11.3902 6.09023 numMergedOcc 0
17 mol 115 unq 1 iso 1 dist 9.56867 7.64822 7.88312 12.7842 8.02349 5.83991 7.44784 11.5723 7.30858 10.8507 12.3154 4.61908 8.66155 6.09023 11.3902 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 6.73365 5.73338 5.6234 12.3723 6.2715 9.0018 9.45659 5.35493 6.57069 8.16421 15.0771 10.5631 9.8589 8.22779 7.5414 numMergedOcc 0
19 mol 175 unq 0 iso 1 dist 6.73365 5.73338 5.6234 9.45659 5.35493 6.57069 12.3723 6.2715 9.0018 8.16421 15.0771 10.5631 9.8589 7.5414 8.22779 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 9.45659 5.73338 6.57069 12.3723 8.16421 9.0018 6.73365 5.35493 5.6234 6.2715 15.0771 7.5414 9.8589 8.22779 10.5631 numMergedOcc 0
21 mol 175 unq 1 iso 1 dist 9.45659 5.73338 6.57069 6.73365 5.35493 5.6234 12.3723 8.16421 9.0018 6.2715 15.0771 7.5414 9.8589 10.5631 8.22779 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 4.79841 11.4653 8.95269 9.04374 4.70378 6.57273 15.1903 11.5372 5.78342 8.49799 11.4157 7.98696 6.87664 7.12232 5.3621 numMergedOcc 0
23 mol 224 unq 0 iso 1 dist 4.79841 11.4653 8.95269 15.1903 11.5372 5.78342 9.04374 4.70378 6.57273 8.49799 11.4157 7.98696 6.87664 5.3621 7.12232 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 10.8312 14.7998 6.84306 5.79505 5.77356 6.40312 7.17676 11.8759 11.3552 numMergedOcc 0
25 mol 236 unq 0 iso 1 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 12.96 14.2337 8.03456 5.79505 5.77356 6.40312 7.17676 11.3552 11.8759 numMergedOcc 0
26 mol 236 unq 1 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 10.8312 14.7998 6.84306 5.79505 9.24309 6.2568 6.68463 9.07822 11.6837 numMergedOcc 0
27 mol 236 unq 1 iso 1 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 12.96 14.2337 8.03456 5.79505 9.24309 6.2568 6.68463 11.6837 9.07822 numMergedOcc 0
28 mol 236 unq 2 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 11.2195 10.7497 9.99038 9.90963 5.77356 6.40312 7.17676 11.8759 6.04825 numMergedOcc 0
29 mol 236 unq 2 iso 1 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 12.96 14.2337 8.03456 9.90963 5.77356 6.40312 7.17676 6.04825 11.8759 numMergedOcc 0
30 mol 236 unq 3 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 11.2195 10.7497 9.99038 9.90963 9.24309 6.2568 6.68463 9.07822 8.8265 numMergedOcc 0
31 mol 236 unq 3 iso 1 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 12.96 14.2337 8.03456 9.90963 9.24309 6.2568 6.68463 8.8265 9.07822 numMergedOcc 0
32 mol 236 unq 4 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 14.0541 12.0369 9.78037 6.96005 5.77356 6.40312 7.17676 11.8759 12.6468 numMergedOcc 0
33 mol 236 unq 4 iso 1 dist 6.73134 5.27568 8.35971 14.0541 12.0369 9.78037 12.96 14.2337 8.03456 6.96005 5.77356 6.40312 7.17676 12.6468 11.8759 numMergedOcc 0
34 mol 236 unq 5 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 14.0541 12.0369 9.78037 6.96005 9.24309 6.2568 6.68463 9.07822 5.80136 numMergedOcc 0
35 mol 236 unq 5 iso 1 dist 6.73134 5.27568 8.35971 14.0541 12.0369 9.78037 12.96 14.2337 8.03456 6.96005 9.24309 6.2568 6.68463 5.80136 9.07822 numMergedOcc 0
36 mol 236 unq 2 iso 0 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 11.2195 10.7497 9.99038 11.3368 5.77356 6.40312 7.17676 11.3552 6.04825 numMergedOcc 0
37 mol 236 unq 2 iso 1 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 10.8312 14.7998 6.84306 11.3368 5.77356 6.40312 7.17676 6.04825 11.3552 numMergedOcc 0
38 mol 236 unq 3 iso 0 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 11.2195 10.7497 9.99038 11.3368 9.24309 6.2568 6.68463 11.6837 8.8265 numMergedOcc 0
39 mol 236 unq 3 iso 1 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 10.8312 14.7998 6.84306 11.3368 9.24309 6.2568 6.68463 8.8265 11.6837 numMergedOcc 0
40 mol 236 unq 4 iso 0 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 14.0541 12.0369 9.78037 11.8739 5.77356 6.40312 7.17676 11.3552 12.6468 numMergedOcc 0
41 mol 236 unq 4 iso 1 dist 6.73134 5.27568 8.35971 14.0541 12.0369 9.78037 10.8312 14.7998 6.84306 11.8739 5.77356 6.40312 7.17676 12.6468 11.3552 numMergedOcc 0
42 mol 236 unq 5 iso 0 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 14.0541 12.0369 9.78037 11.8739 9.24309 6.2568 6.68463 11.6837 5.80136 numMergedOcc 0
43 mol 236 unq 5 iso 1 dist 6.73134 5.27568 8.35971 14.0541 12.0369 9.78037 10.8312 14.7998 6.84306 11.8739 9.24309 6.2568 6.68463 5.80136 11.6837 numMergedOcc 0
44 mol 236 unq 4 iso 0 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 14.0541 12.0369 9.78037 11.1557 5.77356 6.40312 7.17676 6.04825 12.6468 numMergedOcc 0
45 mol 236 unq 4 iso 1 dist 6.73134 5.27568 8.35971 14.0541 12.0369 9.78037 11.2195 10.7497 9.99038 11.1557 5.77356 6.40312 7.17676 12.6468 6.04825 numMergedOcc 0
46 mol 236 unq 5 iso 0 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 14.0541 12.0369 9.78037 11.1557 9.24309 6.2568 6.68463 8.8265 5.80136 numMergedOcc 0
47 mol 236 unq 5 iso 1 dist 6.73134 5.27568 8.35971 14.0541 12.0369 9.78037 11.2195 10.7497 9.99038 11.1557 9.24309 6.2568 6.68463 5.80136 8.8265 numMergedOcc 0
48 mol 248 unq 0 iso 0 dist 6.44967 9.48478 7.69895 11.4848 5.55137 7.21521 15.9246 10.8081 8.2965 5.86196 9.83514 6.48757 6.07192 5.51827 9.29921 numMergedOcc 0
49 mol 248 unq 0 iso 1 dist 6.44967 9.48478 7.69895 15.9246 10.8081 8.2965 11.4848 5.55137 7.21521 5.86196 9.83514 6.48757 6.07192 9.29921 5.51827 numMergedOcc 0
50 mol 259 unq 0 iso 0 dist 6.96379 12.7595 7.88519 11.7889 4.86771 7.84554 11.1532 6.96053 7.46176 7.64658 15.1733 11.6195 7.48005 11.8736 5.79468 numMergedOcc 0
51 mol 259 unq 0 iso 1 dist 6.96379 12.7595 7.88519 11.1532 6.96053 7.46176 11.7889 4.86771 7.84554 7.64658 15.1733 11.6195 7.48005 5.79468 11.8736 numMergedOcc 0
52 mol 259 unq 1 iso 0 dist 6.96379 12.7595 7.88519 11.7889 4.86771 7.84554 17.4423 10.4881 9.18903 5.87173 15.1733 11.6195 7.48005 11.8736 12.6649 numMergedOcc 0
53 mol 259 unq 1 iso 1 dist 6.96379 12.7595 7.88519 17.4423 10.4881 9.18903 11.7889 4.86771 7.84554 5.87173 15.1733 11.6195 7.48005 12.6649 11.8736 numMergedOcc 0
54 mol 259 unq 1 iso 0 dist 6.96379 12.7595 7.88519 11.1532 6.96053 7.46176 17.4423 10.4881 9.18903 10.5239 15.1733 11.6195 7.48005 5.79468 12.6649 numMergedOcc 0
55 mol 259 unq 1 iso 1 dist 6.96379 12.7595 7.88519 17.4423 10.4881 9.18903 11.1532 6.96053 7.46176 10.5239 15.1733 11.6195 7.48005 12.6649 5.79468 numMergedOcc 0
56 mol 282 unq 0 iso 0 dist 8.58671 8.13794 8.04483 14.7737 10.0156 8.76532 11.0247 5.39891 6.33524 4.66602 15.6696 10.1236 8.8673 8.14825 7.36881 numMergedOcc 0
57 mol 282 unq 0 iso 1 dist 8.58671 8.13794 8.04483 11.0247 5.39891 6.33524 14.7737 10.0156 8.76532 4.66602 15.6696 10.1236 8.8673 7.36881 8.14825 numMergedOcc 0
58 mol 282 unq 1 iso 0 dist 6.84554 9.67023 8.76532 14.1723 10.0156 8.04483 9.51581 4.66602 6.33524 5.39891 13.2331 8.14825 8.8673 10.1236 7.36881 numMergedOcc 0
59 mol 282 unq 1 iso 1 dist 6.84554 9.67023 8.76532 9.51581 4.66602 6.33524 14.1723 10.0156 8.04483 5.39891 13.2331 8.14825 8.8673 7.36881 10.1236 numMergedOcc 0
60 mol 282 unq 2 iso 0 dist 9.51581 9.67023 6.33524 14.1723 5.39891 8.04483 6.84554 4.66602 8.76532 10.0156 13.2331 7.36881 8.8673 10.1236 8.14825 numMergedOcc 0
61 mol 282 unq 2 iso 1 dist 9.51581 9.67023 6.33524 6.84554 4.66602 8.76532 14.1723 5.39891 8.04483 10.0156 13.2331 7.36881 8.8673 8.14825 10.1236 numMergedOcc 0
