0 mol 26 unq 0 iso 0 dist 9.46609 6.0606 6.38243 9.54853 9.41425 4.73981 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 6.12212 8.45505 7.99016 6.18479 8.55553 5.84083 numMergedOcc 0
2 mol 39 unq 1 iso 0 dist 6.12212 8.45505 7.99016 3.81369 5.00813 6.92307 numMergedOcc 0
3 mol 39 unq 2 iso 0 dist 6.12212 8.17661 6.41793 6.18479 8.55553 5.16873 numMergedOcc 0
4 mol 39 unq 3 iso 0 dist 6.12212 8.17661 6.41793 3.81369 5.00813 7.52517 numMergedOcc 0
5 mol 39 unq 4 iso 0 dist 6.12212 3.85593 6.50101 6.18479 8.55553 3.08793 numMergedOcc 0
6 mol 39 unq 5 iso 0 dist 6.12212 3.85593 6.50101 3.81369 5.00813 4.6056 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 5.9644 8.17555 7.4515 6.42684 4.92457 4.73277 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.53468 10.0936 7.69861 12.7709 8.59337 9.21869 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.53468 10.0936 7.69861 13.1304 7.66942 6.06973 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 5.90954 3.45332 7.69861 7.78675 8.59337 9.21869 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 5.90954 3.45332 7.69861 7.76917 7.66942 6.06973 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 7.81334 10.4613 9.86664 7.43211 6.97741 3.37578 numMergedOcc 0
13 mol 79 unq 0 iso 0 dist 5.69384 6.35003 8.04168 6.08635 8.51933 12.3073 numMergedOcc 0
14 mol 79 unq 1 iso 0 dist 5.69384 3.45432 5.70907 6.08635 8.51933 3.29053 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 8.42713 3.91263 7.8435 14.4533 6.46217 13.6138 numMergedOcc 0
16 mol 93 unq 1 iso 0 dist 8.42713 5.59024 5.99269 14.4533 6.46217 12.3588 numMergedOcc 0
17 mol 93 unq 2 iso 0 dist 8.42713 12.9872 5.71763 14.4533 6.46217 4.98621 numMergedOcc 0
18 mol 93 unq 3 iso 0 dist 8.21032 15.8131 7.8435 3.24551 6.46217 13.6138 numMergedOcc 0
19 mol 93 unq 4 iso 0 dist 8.21032 13.6266 5.99269 3.24551 6.46217 12.3588 numMergedOcc 0
20 mol 93 unq 5 iso 0 dist 8.21032 5.17052 5.71763 3.24551 6.46217 4.98621 numMergedOcc 0
21 mol 128 unq 0 iso 0 dist 6.17362 6.84628 9.12084 3.81254 7.12765 3.58393 numMergedOcc 0
22 mol 128 unq 1 iso 0 dist 6.17362 6.84628 9.12084 6.13996 6.28471 7.73275 numMergedOcc 0
23 mol 128 unq 2 iso 0 dist 6.4416 8.84157 9.12084 7.67031 7.12765 3.58393 numMergedOcc 0
24 mol 128 unq 3 iso 0 dist 6.4416 8.84157 9.12084 4.62046 6.28471 7.73275 numMergedOcc 0
25 mol 128 unq 4 iso 0 dist 6.91935 4.99095 9.12084 4.79627 7.12765 3.58393 numMergedOcc 0
26 mol 128 unq 5 iso 0 dist 6.91935 4.99095 9.12084 4.769 6.28471 7.73275 numMergedOcc 0
27 mol 147 unq 0 iso 0 dist 6.4752 11.5768 9.43989 11.3398 7.19893 15.2813 numMergedOcc 0
28 mol 147 unq 1 iso 0 dist 6.4752 11.5768 9.43989 6.78721 6.37938 14.3635 numMergedOcc 0
29 mol 158 unq 0 iso 0 dist 6.92225 9.02669 6.11331 10.5886 8.06621 11.6769 numMergedOcc 0
30 mol 173 unq 0 iso 0 dist 5.36078 3.83661 7.17037 12.3916 9.02222 11.5009 numMergedOcc 0
31 mol 186 unq 0 iso 0 dist 9.93045 11.8169 8.31881 13.9439 9.12783 3.11607 numMergedOcc 0
32 mol 218 unq 0 iso 0 dist 9.6309 5.64434 8.04838 8.71194 6.62738 9.10705 numMergedOcc 0
33 mol 218 unq 1 iso 0 dist 9.6309 5.64434 8.04838 5.07361 7.13254 8.25033 numMergedOcc 0
34 mol 250 unq 0 iso 0 dist 9.43554 6.9412 7.22664 7.81555 7.5999 3.18526 numMergedOcc 0
35 mol 250 unq 1 iso 0 dist 9.43554 6.9412 7.22664 9.41799 9.50976 4.97183 numMergedOcc 0
36 mol 250 unq 2 iso 0 dist 9.43554 6.56481 7.15762 7.81555 7.5999 9.28743 numMergedOcc 0
37 mol 250 unq 3 iso 0 dist 9.43554 6.56481 7.15762 9.41799 9.50976 6.00379 numMergedOcc 0
38 mol 250 unq 4 iso 0 dist 9.21681 15.9167 7.22664 16.7301 7.5999 3.18526 numMergedOcc 0
39 mol 250 unq 5 iso 0 dist 9.21681 15.9167 7.22664 16.2129 9.50976 4.97183 numMergedOcc 0
40 mol 250 unq 6 iso 0 dist 9.21681 12.9916 7.15762 16.7301 7.5999 9.28743 numMergedOcc 0
41 mol 250 unq 7 iso 0 dist 9.21681 12.9916 7.15762 16.2129 9.50976 6.00379 numMergedOcc 0
42 mol 252 unq 0 iso 0 dist 9.81593 9.75376 8.19529 18.713 9.76731 14.7399 numMergedOcc 0
43 mol 252 unq 1 iso 0 dist 9.81593 9.75376 8.19529 15.0079 8.38599 9.50623 numMergedOcc 0
44 mol 252 unq 2 iso 0 dist 9.81593 10.8474 6.45396 18.713 9.76731 10.4834 numMergedOcc 0
45 mol 252 unq 3 iso 0 dist 9.81593 10.8474 6.45396 15.0079 8.38599 4.73966 numMergedOcc 0
46 mol 252 unq 4 iso 0 dist 9.78248 12.4311 8.19529 3.91004 9.76731 14.7399 numMergedOcc 0
47 mol 252 unq 5 iso 0 dist 9.78248 12.4311 8.19529 3.76825 8.38599 9.50623 numMergedOcc 0
48 mol 252 unq 6 iso 0 dist 9.78248 8.1205 6.45396 3.91004 9.76731 10.4834 numMergedOcc 0
49 mol 252 unq 7 iso 0 dist 9.78248 8.1205 6.45396 3.76825 8.38599 4.73966 numMergedOcc 0
50 mol 264 unq 0 iso 0 dist 8.28871 3.63202 7.14086 9.86659 8.78525 10.1726 numMergedOcc 0
51 mol 264 unq 1 iso 0 dist 7.94668 13.3131 7.14086 9.26671 8.78525 10.1726 numMergedOcc 0
52 mol 270 unq 0 iso 0 dist 4.95899 8.4597 8.49032 4.67653 8.38298 10.9434 numMergedOcc 0
