0 mol 122 unq 0 iso 0 dist 9.62551 6.80798 10.4526 6.25432 10.6398 4.821 13.8174 14.8752 7.33765 8.9864 numMergedOcc 0
1 mol 192 unq 0 iso 0 dist 5.21088 5.05414 3.9335 4.65303 7.36571 5.03588 12.3136 11.1205 10.9472 9.80122 numMergedOcc 0
2 mol 192 unq 1 iso 0 dist 5.21088 5.05414 3.9335 4.65303 7.36571 5.03588 8.25609 8.74203 10.6087 9.17137 numMergedOcc 0
3 mol 192 unq 2 iso 0 dist 9.78743 5.05414 10.6325 4.65303 12.4457 5.03588 5.21088 11.6247 3.9335 7.36571 numMergedOcc 0
4 mol 192 unq 3 iso 0 dist 9.78743 5.05414 10.6325 4.65303 12.4457 5.03588 12.3136 21.2239 10.9472 9.80122 numMergedOcc 0
5 mol 192 unq 4 iso 0 dist 9.78743 5.05414 10.6325 4.65303 12.4457 5.03588 8.25609 17.766 10.6087 9.17137 numMergedOcc 0
6 mol 192 unq 5 iso 0 dist 8.25609 5.05414 10.6087 4.65303 9.17137 5.03588 5.21088 8.74203 3.9335 7.36571 numMergedOcc 0
7 mol 192 unq 6 iso 0 dist 8.25609 5.05414 10.6087 4.65303 9.17137 5.03588 12.3136 8.95038 10.9472 9.80122 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 9.85777 8.93485 10.5366 11.2438 16.3219 8.83628 14.7719 17.2947 9.70513 4.81837 numMergedOcc 0
9 mol 205 unq 1 iso 0 dist 9.85777 8.93485 10.5366 11.2438 16.3219 8.83628 8.47833 15.3805 6.82382 6.43519 numMergedOcc 0
10 mol 205 unq 2 iso 0 dist 8.47833 8.93485 6.82382 11.2438 6.43519 8.83628 14.7719 9.98031 9.70513 4.81837 numMergedOcc 0
11 mol 205 unq 3 iso 0 dist 5.05912 8.93485 9.27501 11.2438 12.9615 8.83628 14.7719 16.5209 9.70513 4.81837 numMergedOcc 0
12 mol 205 unq 4 iso 0 dist 5.05912 8.93485 9.27501 11.2438 12.9615 8.83628 8.47833 7.69037 6.82382 6.43519 numMergedOcc 0
13 mol 205 unq 5 iso 0 dist 5.47586 5.66636 6.82382 7.47443 6.43519 8.83628 10.6964 9.98031 9.70513 4.81837 numMergedOcc 0
14 mol 205 unq 6 iso 0 dist 6.60429 5.66636 9.27501 7.47443 12.9615 8.83628 10.6964 16.5209 9.70513 4.81837 numMergedOcc 0
15 mol 205 unq 7 iso 0 dist 6.60429 5.66636 9.27501 7.47443 12.9615 8.83628 5.47586 7.69037 6.82382 6.43519 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 5.70065 9.49242 5.81094 13.3519 10.3236 7.95917 14.1595 10.0214 4.68656 8.05949 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.80006 7.93375 3.94797 5.54798 10.0796 6.48382 12.9059 10.5109 7.63149 9.0836 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 9.80006 7.93375 3.94797 5.54798 10.0796 6.48382 11.907 5.6921 4.39553 9.62494 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 5.90728 9.35302 12.6455 7.83784 12.7559 5.38739 13.8701 15.6683 8.09099 9.28067 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 7.38536 5.28731 3.57803 6.37482 6.32984 7.08681 13.5396 8.70014 11.2722 7.872 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 7.3388 7.97466 5.03775 6.96774 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 6.96248 8.60638 8.95194 7.14859 numMergedOcc 0
23 mol 287 unq 2 iso 0 dist 6.19545 6.16127 4.00861 5.27724 5.15923 6.25845 12.2535 7.06161 8.01657 8.40726 numMergedOcc 0
24 mol 287 unq 3 iso 0 dist 7.3388 6.16127 5.03775 5.66584 6.96774 9.31611 6.96248 7.11169 8.95194 7.14859 numMergedOcc 0
25 mol 287 unq 4 iso 0 dist 7.3388 6.16127 5.03775 5.27724 10.2812 6.25845 12.2535 12.8236 8.01657 8.40726 numMergedOcc 0
26 mol 287 unq 5 iso 0 dist 7.3388 6.16127 5.03775 5.27724 10.2812 6.25845 6.19545 7.97466 4.00861 5.15923 numMergedOcc 0
27 mol 287 unq 6 iso 0 dist 6.96248 6.16127 8.95194 5.66584 7.14859 9.31611 7.3388 7.11169 5.03775 6.96774 numMergedOcc 0
28 mol 287 unq 7 iso 0 dist 6.96248 6.16127 8.95194 5.27724 11.2356 6.25845 12.2535 15.5054 8.01657 8.40726 numMergedOcc 0
29 mol 287 unq 8 iso 0 dist 6.96248 6.16127 8.95194 5.27724 11.2356 6.25845 6.19545 8.60638 4.00861 5.15923 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 7.3388 7.97466 5.03775 6.96774 numMergedOcc 0
31 mol 288 unq 1 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 6.96248 8.60638 8.95194 7.14859 numMergedOcc 0
32 mol 288 unq 2 iso 0 dist 6.19545 6.16127 4.00861 5.27724 5.15923 6.25845 12.2535 7.06161 8.01657 8.40726 numMergedOcc 0
33 mol 288 unq 3 iso 0 dist 7.3388 6.16127 5.03775 5.66584 6.96774 9.31611 6.96248 7.11169 8.95194 7.14859 numMergedOcc 0
34 mol 288 unq 4 iso 0 dist 7.3388 6.16127 5.03775 5.27724 10.2812 6.25845 12.2535 12.8236 8.01657 8.40726 numMergedOcc 0
35 mol 288 unq 5 iso 0 dist 7.3388 6.16127 5.03775 5.27724 10.2812 6.25845 6.19545 7.97466 4.00861 5.15923 numMergedOcc 0
36 mol 288 unq 6 iso 0 dist 6.96248 6.16127 8.95194 5.66584 7.14859 9.31611 7.3388 7.11169 5.03775 6.96774 numMergedOcc 0
37 mol 288 unq 7 iso 0 dist 6.96248 6.16127 8.95194 5.27724 11.2356 6.25845 12.2535 15.5054 8.01657 8.40726 numMergedOcc 0
38 mol 288 unq 8 iso 0 dist 6.96248 6.16127 8.95194 5.27724 11.2356 6.25845 6.19545 8.60638 4.00861 5.15923 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 7.3388 7.97466 5.03775 6.96774 numMergedOcc 0
40 mol 289 unq 1 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 6.96248 8.60638 8.95194 7.14859 numMergedOcc 0
41 mol 289 unq 2 iso 0 dist 6.19545 6.16127 4.00861 5.27724 5.15923 6.25845 12.2535 7.06161 8.01657 8.40726 numMergedOcc 0
42 mol 289 unq 3 iso 0 dist 7.3388 6.16127 5.03775 5.66584 6.96774 9.31611 6.96248 7.11169 8.95194 7.14859 numMergedOcc 0
43 mol 289 unq 4 iso 0 dist 7.3388 6.16127 5.03775 5.27724 10.2812 6.25845 12.2535 12.8236 8.01657 8.40726 numMergedOcc 0
44 mol 289 unq 5 iso 0 dist 7.3388 6.16127 5.03775 5.27724 10.2812 6.25845 6.19545 7.97466 4.00861 5.15923 numMergedOcc 0
45 mol 289 unq 6 iso 0 dist 6.96248 6.16127 8.95194 5.66584 7.14859 9.31611 7.3388 7.11169 5.03775 6.96774 numMergedOcc 0
46 mol 289 unq 7 iso 0 dist 6.96248 6.16127 8.95194 5.27724 11.2356 6.25845 12.2535 15.5054 8.01657 8.40726 numMergedOcc 0
47 mol 289 unq 8 iso 0 dist 6.96248 6.16127 8.95194 5.27724 11.2356 6.25845 6.19545 8.60638 4.00861 5.15923 numMergedOcc 0
