0 mol 7 unq 0 iso 0 dist 8.75465 15.0884 9.87885 9.69313 8.15894 10.2446 13.0935 12.8323 8.41585 7.88043 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.75465 15.0884 9.87885 5.28778 8.45544 12.3097 13.0935 12.8323 8.41585 8.80762 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.75465 6.3236 6.1206 9.69313 8.15894 5.44992 12.8676 7.12508 7.10621 5.72491 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.75465 6.3236 6.1206 5.28778 8.45544 4.74523 12.8676 7.12508 7.10621 9.67579 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.48944 14.0586 7.27472 8.65417 7.96195 10.0655 10.6551 5.50396 7.36323 11.9933 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.6834 13.4994 7.95042 11.8013 8.24948 6.58998 9.88461 5.69214 6.86014 10.7114 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 6.6834 13.4994 7.95042 11.8013 8.24948 6.58998 9.79529 5.11636 8.86116 6.72502 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 8.74209 5.5249 6.6263 11.8036 7.15901 7.05402 8.06275 5.41726 8.80331 10.0649 numMergedOcc 0
8 mol 43 unq 1 iso 0 dist 8.74209 10.4413 6.75943 11.8036 7.15901 5.48048 12.0618 4.96926 5.73819 8.44903 numMergedOcc 0
9 mol 43 unq 2 iso 0 dist 8.74209 10.4413 6.75943 11.8036 7.15901 5.48048 8.06275 5.41726 6.20293 10.0649 numMergedOcc 0
10 mol 43 unq 3 iso 0 dist 8.74209 10.4413 6.75943 11.8036 7.15901 5.48048 14.4184 10.0383 8.93915 13.5072 numMergedOcc 0
11 mol 43 unq 4 iso 0 dist 9.85555 5.46715 6.6263 9.77201 7.15901 7.05402 13.5835 5.41726 8.80331 10.0649 numMergedOcc 0
12 mol 43 unq 5 iso 0 dist 9.85555 12.902 6.75943 9.77201 7.15901 5.48048 14.4841 4.96926 5.73819 8.44903 numMergedOcc 0
13 mol 43 unq 6 iso 0 dist 9.85555 12.902 6.75943 9.77201 7.15901 5.48048 13.5835 5.41726 6.20293 10.0649 numMergedOcc 0
14 mol 43 unq 7 iso 0 dist 9.85555 12.902 6.75943 9.77201 7.15901 5.48048 19.4359 10.0383 8.93915 13.5072 numMergedOcc 0
15 mol 56 unq 0 iso 0 dist 8.15039 7.70367 9.03564 4.24044 7.06146 10.1082 11.5793 6.75591 8.66265 12.6652 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 5.91797 9.41666 7.54889 9.74702 6.83746 13.9572 9.32725 10.4782 6.10456 15.6191 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 5.91797 9.41666 7.54889 10.213 9.14707 13.1975 9.32725 10.4782 6.10456 12.285 numMergedOcc 0
18 mol 98 unq 2 iso 0 dist 6.37954 5.90686 5.10496 10.7165 8.75597 7.32662 9.32725 3.9764 5.08437 7.26086 numMergedOcc 0
19 mol 98 unq 3 iso 0 dist 6.37954 5.90686 5.10496 10.213 9.18457 12.3881 9.32725 3.9764 5.08437 12.285 numMergedOcc 0
20 mol 98 unq 4 iso 0 dist 6.37954 11.2946 5.92242 10.7165 8.75597 13.4985 9.32725 3.9764 6.48948 7.26086 numMergedOcc 0
21 mol 98 unq 5 iso 0 dist 6.37954 11.2946 5.92242 10.213 9.18457 7.89505 9.32725 3.9764 6.48948 12.285 numMergedOcc 0
22 mol 98 unq 6 iso 0 dist 6.37954 9.41666 5.2571 10.7165 8.75597 6.934 9.32725 3.9764 6.10456 7.26086 numMergedOcc 0
23 mol 98 unq 7 iso 0 dist 6.37954 9.41666 5.2571 10.213 9.18457 13.1975 9.32725 3.9764 6.10456 12.285 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 7.76446 10.4858 9.1998 9.75179 6.99345 5.12325 9.79337 12.8086 9.86662 8.20836 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 7.76446 10.4858 9.1998 9.75179 6.99345 5.12325 10.5814 15.0225 9.71307 10.873 numMergedOcc 0
26 mol 134 unq 2 iso 0 dist 6.14652 7.07625 9.33094 9.75179 5.11043 9.4027 9.79337 7.41373 8.94367 8.20836 numMergedOcc 0
27 mol 134 unq 3 iso 0 dist 6.14652 7.07625 9.33094 9.75179 5.11043 9.4027 10.5814 10.8635 6.37586 10.873 numMergedOcc 0
28 mol 134 unq 4 iso 0 dist 6.14652 7.07625 9.33094 9.75179 5.11043 9.4027 9.42271 12.3479 6.49416 13.846 numMergedOcc 0
29 mol 134 unq 5 iso 0 dist 6.14652 10.4858 8.69531 9.75179 5.11043 5.12325 9.79337 7.41373 9.86662 8.20836 numMergedOcc 0
30 mol 134 unq 6 iso 0 dist 6.14652 10.4858 8.69531 9.75179 5.11043 5.12325 10.5814 10.8635 9.71307 10.873 numMergedOcc 0
31 mol 143 unq 0 iso 0 dist 9.11314 10.5234 5.37047 11.3023 8.612 9.23795 12.9413 4.78563 5.99315 7.25673 numMergedOcc 0
32 mol 152 unq 0 iso 0 dist 9.4275 5.65129 6.59889 12.369 7.1069 7.2238 8.34839 5.39112 8.56324 10.4911 numMergedOcc 0
33 mol 152 unq 1 iso 0 dist 9.4275 10.5295 6.70693 12.369 7.1069 5.59336 12.6531 4.94983 5.87555 8.35555 numMergedOcc 0
34 mol 152 unq 2 iso 0 dist 9.4275 10.5295 6.70693 12.369 7.1069 5.59336 8.34839 5.39112 6.70283 10.4911 numMergedOcc 0
35 mol 152 unq 3 iso 0 dist 9.4275 10.5295 6.70693 12.369 7.1069 5.59336 14.5994 9.67475 8.67331 13.0858 numMergedOcc 0
36 mol 205 unq 0 iso 0 dist 6.32553 9.40714 6.52816 9.91251 7.53395 5.54129 13.7769 9.49403 6.03031 10.8209 numMergedOcc 0
37 mol 205 unq 1 iso 0 dist 6.32553 9.40714 6.52816 9.91251 7.53395 5.54129 16.4532 13.514 7.26832 10.0424 numMergedOcc 0
38 mol 205 unq 2 iso 0 dist 6.32553 9.40714 6.52816 9.91251 7.53395 5.54129 9.25882 3.56269 7.80463 10.03 numMergedOcc 0
39 mol 234 unq 0 iso 0 dist 9.73257 14.9272 7.81215 5.644 9.08151 11.113 21.1847 12.4252 9.45496 18.9709 numMergedOcc 0
40 mol 234 unq 1 iso 0 dist 9.73257 14.9272 7.81215 5.644 9.08151 11.113 13.4679 5.75498 6.7625 11.968 numMergedOcc 0
41 mol 252 unq 0 iso 0 dist 7.95045 7.16035 7.15764 11.5778 9.39658 13.9054 11.4163 7.40852 7.19638 10.7615 numMergedOcc 0
42 mol 252 unq 1 iso 0 dist 7.95045 7.16035 7.15764 5.63924 5.9974 7.63376 11.4163 7.40852 7.19638 7.50201 numMergedOcc 0
