0 mol 0 unq 0 iso 0 dist 7.96742 5.55156 11.962 7.1599 15.0192 7.15528 12.3538 19.0121 7.19817 9.6994 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.24206 9.5614 13.3337 5.25456 7.37981 7.15528 13.5517 12.7599 7.19817 9.6994 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 9.5614 6.83587 5.25456 7.19621 7.15528 13.5517 9.95 7.19817 9.6994 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19397 5.55156 6.83587 7.1599 7.19621 7.15528 12.3538 9.95 7.19817 9.6994 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 9.31149 8.17898 7.59626 5.72175 10.6144 5.05803 10.6491 11.7457 6.92781 6.31718 numMergedOcc 0
5 mol 16 unq 1 iso 0 dist 7.88676 7.46752 6.53177 5.66097 5.84479 7.63133 10.8592 5.35079 10.8455 6.31718 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 9.3147 7.84393 10.5285 9.01721 13.1233 7.82074 14.9301 13.5255 10.3915 8.4674 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 9.3147 7.84393 10.5285 9.01721 13.1233 7.82074 10.1953 13.4414 5.03957 4.54938 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 9.79426 7.84393 9.84922 9.01721 13.8602 7.82074 14.9301 19.6876 10.3915 8.4674 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 9.79426 7.84393 9.84922 9.01721 13.8602 7.82074 10.1953 12.4435 5.03957 4.54938 numMergedOcc 0
10 mol 60 unq 0 iso 0 dist 9.54864 8.8058 6.0993 12.5818 11.8302 6.43294 17.8366 14.0434 10.6819 6.65595 numMergedOcc 0
11 mol 60 unq 1 iso 0 dist 9.54864 8.8058 6.0993 12.5818 11.8302 6.43294 17.4408 12.7263 11.3621 9.25011 numMergedOcc 0
12 mol 60 unq 2 iso 0 dist 9.54864 8.8058 6.0993 12.5818 11.8302 6.43294 12.1949 5.29535 5.51199 8.52121 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 10.392 10.4716 5.4148 9.96396 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 18.5427 13.9156 13.3558 8.70481 numMergedOcc 0
15 mol 73 unq 2 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 10.392 8.31041 5.4148 9.96396 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 18.5427 11.2674 13.3558 8.70481 numMergedOcc 0
17 mol 73 unq 4 iso 0 dist 8.60363 6.30194 8.0624 10.5627 10.1503 6.19304 10.392 11.7069 5.4148 9.96396 numMergedOcc 0
18 mol 73 unq 5 iso 0 dist 8.60363 6.30194 8.0624 10.5627 10.1503 6.19304 18.5427 14.5102 13.3558 8.70481 numMergedOcc 0
19 mol 75 unq 0 iso 0 dist 7.89636 7.118 6.33557 5.06305 10.6919 7.79912 8.24814 4.67917 5.64643 8.56639 numMergedOcc 0
20 mol 75 unq 1 iso 0 dist 7.89636 7.118 6.33557 5.06305 10.6919 7.79912 11.548 11.5212 10.4899 8.59017 numMergedOcc 0
21 mol 75 unq 2 iso 0 dist 7.89636 8.24814 4.67917 5.06305 10.6919 8.56639 7.118 6.33557 5.64643 7.79912 numMergedOcc 0
22 mol 75 unq 3 iso 0 dist 7.89636 8.24814 4.67917 5.06305 10.6919 8.56639 11.548 11.5212 7.00674 8.59017 numMergedOcc 0
23 mol 75 unq 4 iso 0 dist 9.49608 7.118 9.95193 5.06305 11.1009 7.79912 8.24814 5.10798 5.64643 8.56639 numMergedOcc 0
24 mol 75 unq 5 iso 0 dist 9.49608 7.118 9.95193 5.06305 11.1009 7.79912 11.548 9.33005 10.4899 8.59017 numMergedOcc 0
25 mol 75 unq 6 iso 0 dist 9.49608 8.24814 5.10798 5.06305 11.1009 8.56639 7.118 9.95193 5.64643 7.79912 numMergedOcc 0
26 mol 75 unq 7 iso 0 dist 9.49608 8.24814 5.10798 5.06305 11.1009 8.56639 11.548 9.33005 7.00674 8.59017 numMergedOcc 0
27 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 6.89762 11.5472 6.45675 10.0165 16.2555 5.33144 7.47343 numMergedOcc 0
28 mol 100 unq 1 iso 0 dist 6.60356 9.57498 14.3495 6.89762 11.5472 6.45675 15.6218 20.1677 9.71151 8.86688 numMergedOcc 0
29 mol 115 unq 0 iso 0 dist 7.67341 8.35604 5.39296 11.9798 10.2695 7.11972 16.1591 11.2571 10.498 6.90986 numMergedOcc 0
30 mol 127 unq 0 iso 0 dist 8.98151 6.65963 5.38 10.345 12.4667 8.14887 8.62711 6.75619 7.30196 9.30299 numMergedOcc 0
31 mol 127 unq 1 iso 0 dist 8.98151 8.62711 6.75619 10.345 12.4667 9.30299 6.65963 5.38 7.30196 8.14887 numMergedOcc 0
32 mol 175 unq 0 iso 0 dist 8.6609 6.73365 6.15969 5.73338 10.7272 5.6234 12.3723 9.78176 6.2715 9.0018 numMergedOcc 0
33 mol 175 unq 1 iso 0 dist 8.6609 6.73365 6.15969 5.73338 10.7272 5.6234 9.45659 11.0866 5.35493 6.57069 numMergedOcc 0
34 mol 175 unq 2 iso 0 dist 8.6609 6.73365 6.15969 12.753 14.7648 9.92231 12.3723 9.78176 6.2715 7.652 numMergedOcc 0
35 mol 175 unq 3 iso 0 dist 8.6609 9.45659 11.0866 5.73338 10.7272 6.57069 12.3723 9.78176 8.16421 9.0018 numMergedOcc 0
36 mol 175 unq 4 iso 0 dist 8.6609 9.45659 11.0866 5.73338 10.7272 6.57069 6.73365 6.15969 5.35493 5.6234 numMergedOcc 0
37 mol 175 unq 5 iso 0 dist 6.21546 6.73365 5.50014 5.73338 8.69888 5.6234 12.3723 11.5099 6.2715 9.0018 numMergedOcc 0
38 mol 175 unq 6 iso 0 dist 6.21546 6.73365 5.50014 5.73338 8.69888 5.6234 9.45659 7.39186 5.35493 6.57069 numMergedOcc 0
39 mol 175 unq 7 iso 0 dist 6.21546 6.73365 5.50014 12.753 14.9263 9.92231 12.3723 11.5099 6.2715 7.652 numMergedOcc 0
40 mol 175 unq 8 iso 0 dist 6.21546 9.45659 7.39186 5.73338 8.69888 6.57069 12.3723 11.5099 8.16421 9.0018 numMergedOcc 0
41 mol 175 unq 9 iso 0 dist 6.21546 9.45659 7.39186 5.73338 8.69888 6.57069 6.73365 5.50014 5.35493 5.6234 numMergedOcc 0
42 mol 175 unq 10 iso 0 dist 6.03184 6.73365 7.28617 5.73338 5.08206 5.6234 12.3723 12.1783 6.2715 9.0018 numMergedOcc 0
43 mol 175 unq 11 iso 0 dist 6.03184 6.73365 7.28617 5.73338 5.08206 5.6234 9.45659 5.77256 5.35493 6.57069 numMergedOcc 0
44 mol 175 unq 12 iso 0 dist 6.03184 6.73365 7.28617 12.753 11.7895 9.92231 12.3723 12.1783 6.2715 7.652 numMergedOcc 0
45 mol 175 unq 13 iso 0 dist 6.03184 9.45659 5.77256 5.73338 5.08206 6.57069 12.3723 12.1783 8.16421 9.0018 numMergedOcc 0
46 mol 175 unq 14 iso 0 dist 6.03184 9.45659 5.77256 5.73338 5.08206 6.57069 6.73365 7.28617 5.35493 5.6234 numMergedOcc 0
47 mol 181 unq 0 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 13.3844 11.067 8.85576 7.81386 numMergedOcc 0
48 mol 186 unq 0 iso 0 dist 6.43585 6.86297 5.43796 8.03427 12.4816 8.87694 10.7452 11.159 5.74635 7.54065 numMergedOcc 0
49 mol 186 unq 1 iso 0 dist 6.43585 6.86297 5.43796 8.03427 12.4816 8.87694 13.9315 17.0943 14.9058 9.70748 numMergedOcc 0
50 mol 224 unq 0 iso 0 dist 7.62593 4.79841 5.41021 11.4653 9.33771 8.95269 9.04374 4.91322 4.70378 6.57273 numMergedOcc 0
51 mol 224 unq 1 iso 0 dist 7.62593 4.79841 5.41021 11.4653 9.33771 8.95269 15.1903 12.979 11.5372 5.78342 numMergedOcc 0
52 mol 236 unq 0 iso 0 dist 9.13126 6.73134 6.0258 5.27568 12.9448 8.35971 12.96 19.8998 14.2337 8.03456 numMergedOcc 0
53 mol 236 unq 1 iso 0 dist 9.13126 6.73134 6.0258 5.27568 12.9448 8.35971 10.8312 19.4534 14.7998 6.84306 numMergedOcc 0
54 mol 236 unq 2 iso 0 dist 9.13126 6.73134 6.0258 5.27568 12.9448 8.35971 11.2195 15.6894 10.7497 9.99038 numMergedOcc 0
55 mol 236 unq 3 iso 0 dist 9.13126 6.73134 6.0258 5.27568 12.9448 8.35971 14.0541 17.9247 12.0369 9.78037 numMergedOcc 0
56 mol 248 unq 0 iso 0 dist 8.11968 6.44967 4.53213 9.48478 8.71859 7.69895 11.4848 6.33032 5.55137 7.21521 numMergedOcc 0
57 mol 248 unq 1 iso 0 dist 8.11968 6.44967 4.53213 9.48478 8.71859 7.69895 15.9246 11.762 10.8081 8.2965 numMergedOcc 0
58 mol 258 unq 0 iso 0 dist 6.08181 8.81059 13.8694 9.78068 15.2652 6.42289 14.0712 18.663 7.26417 6.60405 numMergedOcc 0
59 mol 258 unq 1 iso 0 dist 7.70189 8.81059 9.22664 9.78068 8.58088 6.42289 14.0712 10.221 7.26417 6.60405 numMergedOcc 0
60 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 10.908 6.77279 8.13497 14.2826 7.55268 10.582 8.53687 numMergedOcc 0
61 mol 259 unq 1 iso 0 dist 6.76656 6.96379 5.71237 12.7595 9.58006 7.88519 11.7889 9.10984 4.86771 7.84554 numMergedOcc 0
62 mol 259 unq 2 iso 0 dist 6.76656 6.96379 5.71237 12.7595 9.58006 7.88519 11.1532 11.8501 6.96053 7.46176 numMergedOcc 0
63 mol 259 unq 3 iso 0 dist 6.76656 6.96379 5.71237 12.7595 9.58006 7.88519 17.4423 13.9868 10.4881 9.18903 numMergedOcc 0
64 mol 261 unq 0 iso 0 dist 6.41477 7.15785 4.50761 6.5875 10.2386 8.02547 13.1629 12.8629 10.0727 8.43057 numMergedOcc 0
65 mol 261 unq 1 iso 0 dist 6.41477 7.15785 4.50761 6.5875 10.2386 8.02547 9.43169 8.80293 5.51688 6.05727 numMergedOcc 0
66 mol 261 unq 2 iso 0 dist 6.41477 9.43169 8.80293 6.5875 10.2386 6.05727 7.15785 4.50761 5.51688 8.02547 numMergedOcc 0
67 mol 261 unq 3 iso 0 dist 6.41477 9.43169 8.80293 6.5875 10.2386 6.05727 13.1629 12.8629 4.63549 8.43057 numMergedOcc 0
68 mol 261 unq 4 iso 0 dist 9.70222 7.6414 11.544 13.6041 17.2791 8.45658 13.063 18.4508 7.00201 9.14619 numMergedOcc 0
69 mol 272 unq 0 iso 0 dist 7.50321 4.78812 5.96981 5.27123 12.4617 8.33638 6.62923 7.55961 5.40809 8.46116 numMergedOcc 0
70 mol 272 unq 1 iso 0 dist 7.50321 6.62923 7.55961 5.27123 12.4617 8.46116 4.78812 5.96981 5.40809 8.33638 numMergedOcc 0
71 mol 272 unq 2 iso 0 dist 9.61597 4.78812 6.76845 5.27123 13.2205 8.33638 6.62923 5.43733 5.40809 8.46116 numMergedOcc 0
72 mol 272 unq 3 iso 0 dist 9.61597 6.62923 5.43733 5.27123 13.2205 8.46116 4.78812 6.76845 5.40809 8.33638 numMergedOcc 0
73 mol 282 unq 0 iso 0 dist 7.93511 6.84554 4.58403 9.67023 5.67266 8.76532 14.1723 9.63727 10.0156 8.04483 numMergedOcc 0
74 mol 282 unq 1 iso 0 dist 7.93511 6.84554 4.58403 9.67023 5.67266 8.76532 9.51581 5.04235 4.66602 6.33524 numMergedOcc 0
75 mol 282 unq 2 iso 0 dist 7.93511 9.51581 5.04235 9.67023 5.67266 6.33524 14.1723 9.63727 5.39891 8.04483 numMergedOcc 0
76 mol 282 unq 3 iso 0 dist 7.93511 9.51581 5.04235 9.67023 5.67266 6.33524 6.84554 4.58403 4.66602 8.76532 numMergedOcc 0
77 mol 282 unq 4 iso 0 dist 5.62497 8.58671 4.85461 8.13794 9.63346 8.04483 14.7737 13.108 10.0156 8.76532 numMergedOcc 0
78 mol 282 unq 5 iso 0 dist 5.62497 8.58671 4.85461 8.13794 9.63346 8.04483 11.0247 8.85797 5.39891 6.33524 numMergedOcc 0
