0 mol 9 unq 0 iso 0 dist 9.93613 11.7623 9.78006 9.03359 8.04924 5.60154 12.0088 7.05919 5.84314 3.91075 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.73259 4.09495 5.69955 10.1809 7.61055 9.87119 5.23054 6.73167 8.25132 10.267 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 6.73259 4.09495 5.69955 10.1809 7.61055 9.87119 6.65309 7.40948 4.94205 6.77624 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 6.73259 8.18809 8.6385 10.1809 7.61055 4.74747 5.23054 6.73167 7.73394 10.267 numMergedOcc 0
4 mol 26 unq 3 iso 0 dist 6.73259 8.18809 8.6385 10.1809 7.61055 4.74747 6.65309 7.40948 7.42064 6.77624 numMergedOcc 0
5 mol 26 unq 4 iso 0 dist 8.60352 8.26353 5.69955 4.53839 7.61055 9.87119 12.0047 6.73167 8.25132 10.267 numMergedOcc 0
6 mol 26 unq 5 iso 0 dist 8.60352 8.26353 5.69955 4.53839 7.61055 9.87119 3.7444 7.40948 4.94205 6.77624 numMergedOcc 0
7 mol 26 unq 6 iso 0 dist 8.60352 7.06347 8.6385 4.53839 7.61055 4.74747 12.0047 6.73167 7.73394 10.267 numMergedOcc 0
8 mol 26 unq 7 iso 0 dist 8.60352 7.06347 8.6385 4.53839 7.61055 4.74747 3.7444 7.40948 7.42064 6.77624 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 8.42713 17.674 9.81831 12.5605 7.85041 8.58164 3.91263 7.8435 16.1023 12.1673 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 8.42713 17.674 9.81831 12.5605 7.85041 8.58164 5.59024 5.99269 13.1721 7.30779 numMergedOcc 0
11 mol 93 unq 2 iso 0 dist 8.42713 17.674 9.81831 12.5605 7.85041 8.58164 12.9872 5.71763 9.34182 9.18194 numMergedOcc 0
12 mol 93 unq 3 iso 0 dist 8.42713 15.232 9.12858 12.5605 7.85041 9.67788 3.91263 7.8435 12.4934 12.1673 numMergedOcc 0
13 mol 93 unq 4 iso 0 dist 8.42713 15.232 9.12858 12.5605 7.85041 9.67788 5.59024 5.99269 11.0537 7.30779 numMergedOcc 0
14 mol 93 unq 5 iso 0 dist 8.42713 15.232 9.12858 12.5605 7.85041 9.67788 12.9872 5.71763 12.0103 9.18194 numMergedOcc 0
15 mol 93 unq 6 iso 0 dist 8.42713 12.5871 9.4523 12.5605 7.85041 5.33106 3.91263 7.8435 10.8106 12.1673 numMergedOcc 0
16 mol 93 unq 7 iso 0 dist 8.42713 12.5871 9.4523 12.5605 7.85041 5.33106 5.59024 5.99269 7.14217 7.30779 numMergedOcc 0
17 mol 93 unq 8 iso 0 dist 8.42713 12.5871 9.4523 12.5605 7.85041 5.33106 12.9872 5.71763 12.9351 9.18194 numMergedOcc 0
18 mol 93 unq 9 iso 0 dist 8.21032 6.25741 9.81831 10.878 7.85041 8.58164 15.8131 7.8435 16.1023 12.1673 numMergedOcc 0
19 mol 93 unq 10 iso 0 dist 8.21032 6.25741 9.81831 10.878 7.85041 8.58164 13.6266 5.99269 13.1721 7.30779 numMergedOcc 0
20 mol 93 unq 11 iso 0 dist 8.21032 6.25741 9.81831 10.878 7.85041 8.58164 5.17052 5.71763 9.34182 9.18194 numMergedOcc 0
21 mol 93 unq 12 iso 0 dist 8.21032 10.0172 9.12858 10.878 7.85041 9.67788 15.8131 7.8435 12.4934 12.1673 numMergedOcc 0
22 mol 93 unq 13 iso 0 dist 8.21032 10.0172 9.12858 10.878 7.85041 9.67788 13.6266 5.99269 11.0537 7.30779 numMergedOcc 0
23 mol 93 unq 14 iso 0 dist 8.21032 10.0172 9.12858 10.878 7.85041 9.67788 5.17052 5.71763 12.0103 9.18194 numMergedOcc 0
24 mol 93 unq 15 iso 0 dist 8.21032 13.6269 9.4523 10.878 7.85041 5.33106 15.8131 7.8435 10.8106 12.1673 numMergedOcc 0
25 mol 93 unq 16 iso 0 dist 8.21032 13.6269 9.4523 10.878 7.85041 5.33106 13.6266 5.99269 7.14217 7.30779 numMergedOcc 0
26 mol 93 unq 17 iso 0 dist 8.21032 13.6269 9.4523 10.878 7.85041 5.33106 5.17052 5.71763 12.9351 9.18194 numMergedOcc 0
27 mol 130 unq 0 iso 0 dist 7.62584 11.4663 8.33077 4.9574 6.42785 8.84655 11.9741 6.5739 7.21225 11.4437 numMergedOcc 0
28 mol 130 unq 1 iso 0 dist 7.39532 3.96103 8.33077 6.53156 6.42785 8.84655 9.25976 6.5739 7.21225 11.4437 numMergedOcc 0
29 mol 130 unq 2 iso 0 dist 6.62468 13.474 9.28592 6.53156 6.82089 10.3933 8.17131 8.24966 8.14075 4.02212 numMergedOcc 0
30 mol 130 unq 3 iso 0 dist 6.62468 13.474 9.28592 4.72188 5.38314 9.16988 8.17131 8.24966 8.14075 5.46642 numMergedOcc 0
31 mol 147 unq 0 iso 0 dist 6.4752 8.95179 5.49226 4.10092 5.1101 5.08802 11.5768 9.43989 12.068 11.4653 numMergedOcc 0
32 mol 147 unq 1 iso 0 dist 6.4752 8.95179 5.49226 4.47436 7.01133 10.1972 11.5768 9.43989 12.068 7.68412 numMergedOcc 0
33 mol 147 unq 2 iso 0 dist 6.4752 10.5583 6.28351 4.10092 5.1101 8.59354 11.5768 9.43989 5.59468 11.4653 numMergedOcc 0
34 mol 147 unq 3 iso 0 dist 6.4752 10.5583 6.28351 4.47436 7.01133 8.54341 11.5768 9.43989 5.59468 7.68412 numMergedOcc 0
35 mol 158 unq 0 iso 0 dist 6.92225 9.86605 7.88319 5.49464 6.39981 6.63727 9.02669 6.11331 13.7172 9.88872 numMergedOcc 0
36 mol 159 unq 0 iso 0 dist 9.90625 10.6428 7.25742 8.34466 7.13269 4.57561 6.30259 6.07821 4.48323 4.27525 numMergedOcc 0
37 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 11.5684 9.77862 15.9311 12.1522 5.53324 10.0756 8.31541 numMergedOcc 0
38 mol 194 unq 1 iso 0 dist 7.47107 10.2633 6.26839 11.5684 9.77862 15.9311 5.18485 6.72182 11.8031 6.72001 numMergedOcc 0
39 mol 194 unq 2 iso 0 dist 7.47107 9.36943 8.12346 11.5684 9.77862 13.7758 12.1522 5.53324 10.2793 8.31541 numMergedOcc 0
40 mol 194 unq 3 iso 0 dist 7.47107 9.36943 8.12346 11.5684 9.77862 13.7758 5.18485 6.72182 9.09233 6.72001 numMergedOcc 0
41 mol 194 unq 4 iso 0 dist 7.47107 7.72655 8.83356 11.5684 9.77862 5.38925 12.1522 5.53324 10.463 8.31541 numMergedOcc 0
42 mol 194 unq 5 iso 0 dist 7.47107 7.72655 8.83356 11.5684 9.77862 5.38925 5.18485 6.72182 4.66791 6.72001 numMergedOcc 0
43 mol 194 unq 6 iso 0 dist 7.47107 4.57265 8.2654 11.5684 9.77862 14.2415 12.1522 5.53324 12.8494 8.31541 numMergedOcc 0
44 mol 194 unq 7 iso 0 dist 7.47107 4.57265 8.2654 11.5684 9.77862 14.2415 5.18485 6.72182 7.73551 6.72001 numMergedOcc 0
45 mol 225 unq 0 iso 0 dist 8.28454 10.754 8.87609 8.59036 7.29542 5.06326 11.1052 9.87668 17.3148 13.317 numMergedOcc 0
46 mol 225 unq 1 iso 0 dist 8.28454 10.754 8.87609 8.59036 7.29542 5.06326 3.60045 8.42121 13.3773 10.43 numMergedOcc 0
47 mol 225 unq 2 iso 0 dist 8.28454 10.754 8.87609 8.59036 7.29542 5.06326 12.7272 7.8744 3.97158 6.24324 numMergedOcc 0
48 mol 225 unq 3 iso 0 dist 8.28454 10.754 8.87609 8.59036 7.29542 5.06326 10.6169 4.98402 9.9875 10.7885 numMergedOcc 0
49 mol 227 unq 0 iso 0 dist 8.12518 12.3465 8.38865 4.71182 9.20589 9.60993 10.4658 5.28771 4.1511 9.08701 numMergedOcc 0
50 mol 227 unq 1 iso 0 dist 8.12518 12.3465 8.38865 7.51342 7.89801 13.3557 10.4658 5.28771 4.1511 12.0749 numMergedOcc 0
51 mol 227 unq 2 iso 0 dist 8.12518 7.2593 5.4694 4.71182 9.20589 5.34702 10.4658 5.28771 4.69247 9.08701 numMergedOcc 0
52 mol 227 unq 3 iso 0 dist 8.12518 7.2593 5.4694 7.51342 7.89801 8.8709 10.4658 5.28771 4.69247 12.0749 numMergedOcc 0
53 mol 237 unq 0 iso 0 dist 9.74081 4.37008 7.42587 9.68452 7.35569 5.54394 6.94282 8.7414 6.01528 9.99177 numMergedOcc 0
54 mol 252 unq 0 iso 0 dist 5.22349 8.32163 6.11473 7.31906 6.57207 4.23801 10.7358 9.39658 5.6214 9.43777 numMergedOcc 0
55 mol 252 unq 1 iso 0 dist 9.81593 8.32163 8.47784 7.31906 5.2361 4.23801 9.75376 8.19529 6.62402 4.21466 numMergedOcc 0
56 mol 252 unq 2 iso 0 dist 9.81593 8.32163 8.47784 7.31906 5.2361 4.23801 10.8474 6.45396 10.2463 6.19861 numMergedOcc 0
57 mol 252 unq 3 iso 0 dist 9.81593 8.32163 8.47784 12.2338 5.57515 13.6996 9.75376 8.19529 6.62402 11.9287 numMergedOcc 0
58 mol 252 unq 4 iso 0 dist 9.81593 8.32163 8.47784 12.2338 5.57515 13.6996 10.8474 6.45396 10.2463 7.84988 numMergedOcc 0
59 mol 252 unq 5 iso 0 dist 9.81593 8.32163 8.47784 14.2535 8.28694 15.4395 9.75376 8.19529 6.62402 11.5083 numMergedOcc 0
60 mol 252 unq 6 iso 0 dist 9.81593 8.32163 8.47784 14.2535 8.28694 15.4395 10.8474 6.45396 10.2463 6.38319 numMergedOcc 0
61 mol 252 unq 7 iso 0 dist 9.81593 10.6815 8.66469 7.31906 5.2361 9.12442 9.75376 8.19529 8.71281 4.21466 numMergedOcc 0
62 mol 252 unq 8 iso 0 dist 9.81593 10.6815 8.66469 7.31906 5.2361 9.12442 10.8474 6.45396 4.54582 6.19861 numMergedOcc 0
63 mol 252 unq 9 iso 0 dist 9.81593 10.6815 8.66469 12.2338 5.57515 7.35945 9.75376 8.19529 8.71281 11.9287 numMergedOcc 0
64 mol 252 unq 10 iso 0 dist 9.81593 10.6815 8.66469 12.2338 5.57515 7.35945 10.8474 6.45396 4.54582 7.84988 numMergedOcc 0
65 mol 252 unq 11 iso 0 dist 9.81593 10.6815 8.66469 14.2535 8.28694 5.26003 9.75376 8.19529 8.71281 11.5083 numMergedOcc 0
66 mol 252 unq 12 iso 0 dist 9.81593 10.6815 8.66469 14.2535 8.28694 5.26003 10.8474 6.45396 4.54582 6.38319 numMergedOcc 0
67 mol 252 unq 13 iso 0 dist 9.78248 16.5062 8.47784 12.8039 5.2361 4.23801 12.4311 8.19529 6.62402 4.21466 numMergedOcc 0
68 mol 252 unq 14 iso 0 dist 9.78248 16.5062 8.47784 12.8039 5.2361 4.23801 8.1205 6.45396 10.2463 6.19861 numMergedOcc 0
69 mol 252 unq 15 iso 0 dist 9.78248 16.5062 8.47784 8.32839 5.57515 13.6996 12.4311 8.19529 6.62402 11.9287 numMergedOcc 0
70 mol 252 unq 16 iso 0 dist 9.78248 16.5062 8.47784 8.32839 5.57515 13.6996 8.1205 6.45396 10.2463 7.84988 numMergedOcc 0
71 mol 252 unq 17 iso 0 dist 9.78248 16.5062 8.47784 5.63228 8.28694 15.4395 12.4311 8.19529 6.62402 11.5083 numMergedOcc 0
72 mol 252 unq 18 iso 0 dist 9.78248 16.5062 8.47784 5.63228 8.28694 15.4395 8.1205 6.45396 10.2463 6.38319 numMergedOcc 0
73 mol 252 unq 19 iso 0 dist 9.78248 9.67333 8.66469 12.8039 5.2361 9.12442 12.4311 8.19529 8.71281 4.21466 numMergedOcc 0
74 mol 252 unq 20 iso 0 dist 9.78248 9.67333 8.66469 12.8039 5.2361 9.12442 8.1205 6.45396 4.54582 6.19861 numMergedOcc 0
75 mol 252 unq 21 iso 0 dist 9.78248 9.67333 8.66469 8.32839 5.57515 7.35945 12.4311 8.19529 8.71281 11.9287 numMergedOcc 0
76 mol 252 unq 22 iso 0 dist 9.78248 9.67333 8.66469 8.32839 5.57515 7.35945 8.1205 6.45396 4.54582 7.84988 numMergedOcc 0
77 mol 252 unq 23 iso 0 dist 9.78248 9.67333 8.66469 5.63228 8.28694 5.26003 12.4311 8.19529 8.71281 11.5083 numMergedOcc 0
78 mol 252 unq 24 iso 0 dist 9.78248 9.67333 8.66469 5.63228 8.28694 5.26003 8.1205 6.45396 4.54582 6.38319 numMergedOcc 0
79 mol 264 unq 0 iso 0 dist 8.28871 11.5671 6.04162 9.63193 9.42738 8.16326 3.63202 7.14086 11.4167 9.04569 numMergedOcc 0
80 mol 264 unq 1 iso 0 dist 8.28871 13.8765 6.14323 9.63193 9.42738 12.3807 3.63202 7.14086 13.2035 9.04569 numMergedOcc 0
81 mol 264 unq 2 iso 0 dist 7.94668 5.21164 6.04162 12.2052 9.42738 8.16326 13.3131 7.14086 11.4167 9.04569 numMergedOcc 0
82 mol 264 unq 3 iso 0 dist 7.94668 6.12009 6.14323 12.2052 9.42738 12.3807 13.3131 7.14086 13.2035 9.04569 numMergedOcc 0
83 mol 279 unq 0 iso 0 dist 5.63154 5.15837 8.29305 7.73611 8.23056 5.3373 3.77031 5.8304 6.5644 6.25207 numMergedOcc 0
84 mol 279 unq 1 iso 0 dist 5.63154 5.15837 8.29305 7.73611 8.23056 5.3373 9.11782 7.37478 8.70069 10.8722 numMergedOcc 0
85 mol 279 unq 2 iso 0 dist 5.63154 8.33297 6.43341 7.73611 8.23056 7.18967 3.77031 5.8304 9.40912 6.25207 numMergedOcc 0
86 mol 279 unq 3 iso 0 dist 5.63154 8.33297 6.43341 7.73611 8.23056 7.18967 9.11782 7.37478 4.14939 10.8722 numMergedOcc 0
