0 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 9.42167 8.80127 7.6222 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 5.80023 7.36323 9.42167 8.80127 11.7026 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.11056 10.4744 8.86116 7.81237 6.07553 5.86882 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.11056 10.4744 8.86116 9.25124 6.48457 9.9259 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.11056 6.9756 8.38394 7.81237 6.07553 3.96228 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 6.11056 6.9756 8.38394 9.25124 6.48457 12.2071 numMergedOcc 0
6 mol 45 unq 0 iso 0 dist 7.19021 4.18584 6.43774 6.14259 7.742 4.11544 numMergedOcc 0
7 mol 45 unq 1 iso 0 dist 7.19021 9.0702 7.2846 6.14259 7.742 4.91588 numMergedOcc 0
8 mol 54 unq 0 iso 0 dist 5.97635 10.7219 9.5589 13.3721 8.58658 14.436 numMergedOcc 0
9 mol 54 unq 1 iso 0 dist 5.97635 6.76462 6.83299 13.3721 8.58658 14.3129 numMergedOcc 0
10 mol 54 unq 2 iso 0 dist 5.97635 13.2619 8.10861 13.3721 8.58658 7.98156 numMergedOcc 0
11 mol 59 unq 0 iso 0 dist 9.00229 10.1484 8.95999 4.16267 8.0413 6.22569 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 8.2377 4.99283 5.93252 8.5355 6.13011 4.22425 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 6.58793 10.1919 7.95579 13.9506 8.81824 6.62562 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 6.58793 9.21014 6.19965 13.9506 8.81824 5.46695 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 6.58793 7.83419 7.66905 13.9506 8.81824 11.3211 numMergedOcc 0
16 mol 113 unq 0 iso 0 dist 8.89481 4.36935 5.86073 6.3954 5.94552 4.38244 numMergedOcc 0
17 mol 114 unq 0 iso 0 dist 9.44713 4.1386 7.35754 6.73633 8.06359 3.9247 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 9.70455 7.23959 9.73907 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 9.70455 7.23959 12.3578 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 5.96555 5.87892 7.80463 9.70455 7.23959 6.06996 numMergedOcc 0
21 mol 206 unq 0 iso 0 dist 9.36079 13.6173 7.7366 18.0054 9.73419 8.77621 numMergedOcc 0
22 mol 206 unq 1 iso 0 dist 9.36079 13.6173 7.7366 7.99847 9.99824 10.2691 numMergedOcc 0
23 mol 206 unq 2 iso 0 dist 7.42904 9.96254 7.7366 15.3124 9.73419 8.77621 numMergedOcc 0
24 mol 206 unq 3 iso 0 dist 7.42904 9.96254 7.7366 5.70517 9.99824 10.2691 numMergedOcc 0
25 mol 222 unq 0 iso 0 dist 9.55777 6.54251 8.01589 11.1449 8.36659 6.24593 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 9.55777 6.54251 8.01589 12.0019 9.18913 6.80274 numMergedOcc 0
27 mol 222 unq 2 iso 0 dist 9.55777 15.3892 7.7699 11.1449 8.36659 7.27562 numMergedOcc 0
28 mol 222 unq 3 iso 0 dist 9.55777 15.3892 7.7699 12.0019 9.18913 8.72187 numMergedOcc 0
29 mol 222 unq 4 iso 0 dist 9.55777 16.4881 7.21333 11.1449 8.36659 10.367 numMergedOcc 0
30 mol 222 unq 5 iso 0 dist 9.55777 16.4881 7.21333 12.0019 9.18913 12.4303 numMergedOcc 0
31 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 7.08451 6.40086 6.16261 numMergedOcc 0
32 mol 234 unq 0 iso 0 dist 7.46434 13.0285 8.41436 16.616 9.18589 10.3659 numMergedOcc 0
33 mol 234 unq 1 iso 0 dist 7.46434 13.9912 8.92474 16.616 9.18589 10.4355 numMergedOcc 0
34 mol 234 unq 2 iso 0 dist 7.50424 6.88707 8.41436 3.52422 9.18589 10.3659 numMergedOcc 0
35 mol 234 unq 3 iso 0 dist 7.50424 8.96936 8.92474 3.52422 9.18589 10.4355 numMergedOcc 0
36 mol 235 unq 0 iso 0 dist 8.48065 5.23741 5.4638 3.50523 8.95981 4.60986 numMergedOcc 0
37 mol 261 unq 0 iso 0 dist 8.65236 4.49913 9.14619 12.3982 9.00426 15.4874 numMergedOcc 0
38 mol 261 unq 1 iso 0 dist 8.65236 4.49913 9.14619 9.84177 8.19348 13.3429 numMergedOcc 0
39 mol 264 unq 0 iso 0 dist 8.19504 3.93713 6.24356 16.2395 8.48407 14.5632 numMergedOcc 0
40 mol 265 unq 0 iso 0 dist 9.772 5.75478 8.4218 9.25703 8.95701 5.78373 numMergedOcc 0
41 mol 277 unq 0 iso 0 dist 9.29635 10.8075 9.7748 13.5349 6.64082 10.9417 numMergedOcc 0
42 mol 279 unq 0 iso 0 dist 7.74162 9.5773 9.70696 6.75173 7.83245 6.36192 numMergedOcc 0
