0 mol 19 unq 0 iso 0 dist 8.4674 4.51865 5.80928 7.67038 4.54938 6.864 4.44441 10.1278 7.7312 10.0411 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.4674 4.51865 5.80928 10.3915 7.82074 11.0366 4.44441 10.1278 7.7312 10.9814 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 4.54938 6.864 5.80928 7.67038 8.4674 4.51865 10.0411 10.1278 7.7312 4.44441 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 4.54938 6.864 5.80928 5.03957 7.82074 11.0366 10.0411 10.1278 7.7312 10.9814 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.86116 6.86014 10.0952 6.44287 8.38394 12.5077 8.66248 14.9512 7.49157 13.6644 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.86116 6.86014 10.0952 6.44287 8.38394 12.5077 6.73521 12.1131 7.73794 10.2883 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 6.20293 8.80331 8.13395 5.06502 5.73819 10.5523 9.86609 11.4251 7.39848 9.80379 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 6.20293 8.80331 8.13395 6.45462 8.93915 14.7803 9.86609 11.4251 7.39848 14.7764 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 7.2846 7.58835 8.81358 5.24762 6.43774 11.2563 5.84319 12.3849 8.27463 9.89212 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 9.4099 6.64012 6.47414 10.6169 9.55426 13.4544 5.87468 12.2384 6.79356 16.0498 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 9.4099 9.55426 10.6169 6.47414 6.64012 13.4544 10.5901 16.824 9.4278 16.2594 numMergedOcc 0
11 mol 58 unq 2 iso 0 dist 9.55426 6.81627 9.7274 10.6169 9.4099 15.2973 4.25144 10.307 7.4785 10.3904 numMergedOcc 0
12 mol 58 unq 3 iso 0 dist 9.55426 7.32874 5.90225 10.6169 9.4099 11.396 8.44881 9.79064 8.34191 5.92761 numMergedOcc 0
13 mol 58 unq 4 iso 0 dist 9.55426 7.32874 5.90225 10.6169 9.4099 11.396 4.25144 10.307 6.39747 10.3904 numMergedOcc 0
14 mol 72 unq 0 iso 0 dist 9.96708 9.78528 8.24309 10.7394 8.8178 9.84449 10.7434 4.86198 6.62699 5.21565 numMergedOcc 0
15 mol 73 unq 0 iso 0 dist 9.96396 9.38498 15.7123 5.4148 6.19304 10.2049 4.73407 11.3218 6.23522 5.17781 numMergedOcc 0
16 mol 73 unq 1 iso 0 dist 9.96396 9.38498 15.7123 14.9342 8.70481 20.257 4.73407 11.3218 6.23522 17.5556 numMergedOcc 0
17 mol 73 unq 2 iso 0 dist 9.96396 8.70481 14.9342 15.7123 9.38498 20.257 15.1432 21.1182 7.37171 24.3878 numMergedOcc 0
18 mol 73 unq 3 iso 0 dist 9.96396 8.70481 14.9342 12.016 9.75218 10.1207 15.1432 21.1182 7.37171 14.1231 numMergedOcc 0
19 mol 85 unq 0 iso 0 dist 7.97049 6.19965 5.42586 6.9948 7.47541 7.66905 8.18948 11.5901 8.04242 14.113 numMergedOcc 0
20 mol 85 unq 1 iso 0 dist 7.47541 7.66905 5.42586 6.9948 7.97049 6.19965 14.113 11.5901 8.04242 8.18948 numMergedOcc 0
21 mol 85 unq 2 iso 0 dist 6.19965 7.95579 4.26409 5.42586 7.97049 11.3023 8.37717 9.90583 9.01812 10.3737 numMergedOcc 0
22 mol 85 unq 3 iso 0 dist 7.66905 7.95579 10.7229 5.42586 7.47541 11.3023 8.37717 15.0494 9.01812 10.3737 numMergedOcc 0
23 mol 85 unq 4 iso 0 dist 7.66905 7.95579 10.7229 10.1164 5.73196 15.309 8.37717 15.0494 9.01812 17.0152 numMergedOcc 0
24 mol 95 unq 0 iso 0 dist 9.01083 7.2658 5.53837 8.18643 7.88289 11.152 4.70965 10.2966 6.38004 11.9526 numMergedOcc 0
25 mol 95 unq 1 iso 0 dist 8.03644 9.03572 16.6055 8.41707 7.27724 16.9836 4.73066 11.5898 7.51733 11.5853 numMergedOcc 0
26 mol 95 unq 2 iso 0 dist 8.03644 8.83255 13.8105 8.41707 7.27724 16.9811 4.73066 11.5898 9.01607 11.5853 numMergedOcc 0
27 mol 115 unq 0 iso 0 dist 7.11972 6.90986 10.498 6.5838 5.11551 11.4095 6.34182 12.8676 5.93278 12.6623 numMergedOcc 0
28 mol 115 unq 1 iso 0 dist 7.11972 6.90986 10.498 6.5838 5.11551 11.4095 8.66957 14.3131 6.19918 15.0349 numMergedOcc 0
29 mol 115 unq 2 iso 0 dist 6.90986 5.39945 5.67807 10.498 7.11972 11.8863 4.18693 9.28256 4.76974 14.1439 numMergedOcc 0
30 mol 115 unq 3 iso 0 dist 6.90986 5.39945 5.67807 10.498 7.11972 11.8863 7.41059 12.9131 8.0336 17.6658 numMergedOcc 0
31 mol 133 unq 0 iso 0 dist 9.52634 6.5107 9.56949 6.69554 9.91388 9.66421 6.12885 11.6108 5.78814 5.81903 numMergedOcc 0
32 mol 133 unq 1 iso 0 dist 9.52634 6.5107 9.56949 7.6656 7.24514 12.0352 6.12885 11.6108 5.78814 11.0915 numMergedOcc 0
33 mol 142 unq 0 iso 0 dist 9.2313 7.73169 5.50998 5.32922 5.31024 7.26382 4.05822 8.04118 8.39035 4.7832 numMergedOcc 0
34 mol 142 unq 1 iso 0 dist 5.31024 7.26382 5.50998 5.32922 9.2313 7.73169 4.7832 8.04118 8.39035 4.05822 numMergedOcc 0
35 mol 142 unq 2 iso 0 dist 7.73169 9.2313 5.50998 5.32922 7.26382 5.31024 4.05822 8.39035 8.04118 4.7832 numMergedOcc 0
36 mol 142 unq 3 iso 0 dist 7.26382 5.31024 5.50998 5.32922 7.73169 9.2313 4.7832 8.39035 8.04118 4.05822 numMergedOcc 0
37 mol 152 unq 0 iso 0 dist 5.87555 6.70283 5.42328 5.49936 8.87437 7.16148 4.73288 7.59457 9.00072 4.70284 numMergedOcc 0
38 mol 152 unq 1 iso 0 dist 5.87555 8.67331 5.54906 5.49936 8.87437 8.05741 4.73288 7.59457 7.55419 4.70284 numMergedOcc 0
39 mol 152 unq 2 iso 0 dist 8.87437 7.16148 5.42328 5.49936 5.87555 6.70283 4.70284 7.59457 9.00072 4.73288 numMergedOcc 0
40 mol 152 unq 3 iso 0 dist 8.87437 8.05741 5.54906 5.49936 5.87555 8.67331 4.70284 7.59457 7.55419 4.73288 numMergedOcc 0
41 mol 152 unq 4 iso 0 dist 6.70283 5.87555 5.42328 7.65448 8.56324 10.399 4.68615 10.338 6.79114 10.6994 numMergedOcc 0
42 mol 152 unq 5 iso 0 dist 6.70283 5.87555 5.42328 7.65448 8.56324 10.399 4.73288 9.00072 7.59457 12.2243 numMergedOcc 0
43 mol 152 unq 6 iso 0 dist 6.70283 5.87555 5.42328 5.49936 7.16148 8.87437 4.68615 10.338 6.79114 9.35878 numMergedOcc 0
44 mol 152 unq 7 iso 0 dist 6.70283 5.87555 5.42328 5.49936 7.16148 8.87437 4.73288 9.00072 7.59457 4.70284 numMergedOcc 0
45 mol 152 unq 8 iso 0 dist 6.70283 8.67331 6.4896 7.65448 8.56324 14.1618 4.73288 9.00072 7.55419 12.2243 numMergedOcc 0
46 mol 152 unq 9 iso 0 dist 6.70283 8.67331 6.4896 5.49936 7.16148 8.05741 4.73288 9.00072 7.55419 4.70284 numMergedOcc 0
47 mol 152 unq 10 iso 0 dist 6.70283 8.56324 7.65448 5.42328 5.87555 10.399 9.73449 11.2397 7.55934 9.75376 numMergedOcc 0
48 mol 152 unq 11 iso 0 dist 6.70283 8.56324 7.65448 6.4896 8.67331 14.1618 9.73449 11.2397 7.55934 14.5097 numMergedOcc 0
49 mol 152 unq 12 iso 0 dist 7.16148 8.87437 5.42328 10.6875 8.56324 10.399 9.35878 10.338 6.79114 10.6994 numMergedOcc 0
50 mol 152 unq 13 iso 0 dist 7.16148 8.87437 5.42328 10.6875 8.56324 10.399 4.70284 9.00072 7.59457 12.2243 numMergedOcc 0
51 mol 152 unq 14 iso 0 dist 7.16148 8.87437 5.42328 5.49936 6.70283 5.87555 9.35878 10.338 6.79114 4.68615 numMergedOcc 0
52 mol 152 unq 15 iso 0 dist 7.16148 8.87437 5.42328 5.49936 6.70283 5.87555 4.70284 9.00072 7.59457 4.73288 numMergedOcc 0
53 mol 152 unq 16 iso 0 dist 7.16148 8.05741 6.4896 10.6875 8.56324 14.1618 4.70284 9.00072 7.55419 12.2243 numMergedOcc 0
54 mol 152 unq 17 iso 0 dist 7.16148 8.05741 6.4896 5.49936 6.70283 8.67331 4.70284 9.00072 7.55419 4.73288 numMergedOcc 0
55 mol 152 unq 18 iso 0 dist 7.16148 8.56324 10.6875 5.42328 8.87437 10.399 9.73449 15.1951 7.55934 9.75376 numMergedOcc 0
56 mol 152 unq 19 iso 0 dist 7.16148 8.56324 10.6875 6.4896 8.05741 14.1618 9.73449 15.1951 7.55934 14.5097 numMergedOcc 0
57 mol 152 unq 20 iso 0 dist 8.67331 5.87555 5.54906 5.49936 8.05741 8.87437 4.68615 10.3706 6.79114 9.35878 numMergedOcc 0
58 mol 152 unq 21 iso 0 dist 8.67331 5.87555 5.54906 5.49936 8.05741 8.87437 4.73288 7.55419 7.59457 4.70284 numMergedOcc 0
59 mol 152 unq 22 iso 0 dist 8.67331 6.70283 6.4896 5.49936 8.05741 7.16148 4.73288 7.55419 9.00072 4.70284 numMergedOcc 0
60 mol 152 unq 23 iso 0 dist 8.05741 8.87437 5.54906 5.49936 8.67331 5.87555 9.35878 10.3706 6.79114 4.68615 numMergedOcc 0
61 mol 152 unq 24 iso 0 dist 8.05741 8.87437 5.54906 5.49936 8.67331 5.87555 4.70284 7.55419 7.59457 4.73288 numMergedOcc 0
62 mol 152 unq 25 iso 0 dist 8.05741 7.16148 6.4896 5.49936 8.67331 6.70283 4.70284 7.55419 9.00072 4.73288 numMergedOcc 0
63 mol 206 unq 0 iso 0 dist 9.774 7.7366 5.63422 10.4 8.02137 11.1804 7.83734 6.23183 4.51255 8.20841 numMergedOcc 0
64 mol 253 unq 0 iso 0 dist 8.31064 6.73034 8.02948 7.25988 7.32223 11.6434 8.57513 13.723 8.94786 12.4657 numMergedOcc 0
65 mol 253 unq 1 iso 0 dist 8.31064 6.73034 8.02948 7.25988 7.32223 11.6434 6.0222 9.19385 9.1927 5.85692 numMergedOcc 0
66 mol 253 unq 2 iso 0 dist 8.31064 6.73034 8.02948 7.25988 7.32223 11.6434 6.93212 7.14243 9.60694 9.00842 numMergedOcc 0
67 mol 253 unq 3 iso 0 dist 8.31064 6.73034 8.02948 7.25988 7.32223 11.6434 10.2118 5.77511 9.27311 11.5574 numMergedOcc 0
