@MOLECULE FDBD03156 27 28 0 0 0 SMALL USER_CHARGES @ATOM 1 O -0.0163 1.3522 0.0095 O.3 1 UNK 0.0000 2 C 0.0021 -0.0041 0.0020 C.ar 1 UNK 0.0000 3 C1 0.0059 -0.6942 -1.2012 C.ar 1 UNK 0.0000 4 C2 0.0246 -2.0746 -1.2072 C.ar 1 UNK 0.0000 5 C3 0.0402 -2.7809 -0.0152 C.ar 1 UNK 0.0000 6 C4 0.0372 -2.1122 1.1892 C.ar 1 UNK 0.0000 7 C5 0.0232 -0.7147 1.2103 C.ar 1 UNK 0.0000 8 C6 0.0204 0.0074 2.4953 C.2 1 UNK 0.0000 9 O1 0.0082 1.2223 2.5094 O.2 1 UNK 0.0000 10 O2 0.0313 -0.6798 3.6544 O.3 1 UNK 0.0000 11 Hg 0.0265 0.3631 5.3020 Hg 1 UNK 0.0000 12 C7 0.0213 1.4863 7.0764 C.ar 1 UNK 0.0000 13 C8 0.0015 2.8674 7.0201 C.ar 1 UNK 0.0000 14 C9 -0.0019 3.6068 8.1881 C.ar 1 UNK 0.0000 15 C10 0.0140 2.9651 9.4124 C.ar 1 UNK 0.0000 16 C11 0.0329 1.5840 9.4686 C.ar 1 UNK 0.0000 17 C12 0.0320 0.8446 8.3007 C.ar 1 UNK 0.0000 18 H -0.0188 1.8162 0.8235 H 1 UNK 0.0000 19 H1 -0.0053 -0.1751 -2.0931 H 1 UNK 0.0000 20 H2 0.0270 -2.5836 -2.1050 H 1 UNK 0.0000 21 H3 0.0541 -3.8127 -0.0297 H 1 UNK 0.0000 22 H4 0.0453 -2.6423 2.0746 H 1 UNK 0.0000 23 H5 -0.0107 3.3464 6.1061 H 1 UNK 0.0000 24 H6 -0.0163 4.6378 8.1461 H 1 UNK 0.0000 25 H7 0.0118 3.5171 10.2844 H 1 UNK 0.0000 26 H8 0.0477 1.1049 10.3826 H 1 UNK 0.0000 27 H9 0.0393 -0.1865 8.3428 H 1 UNK 0.0000 @BOND 1 1 2 1 2 2 7 ar 3 2 3 ar 4 3 4 ar 5 4 5 ar 6 5 6 ar 7 6 7 ar 8 7 8 1 9 8 9 2 10 8 10 1 11 10 11 1 12 11 12 1 13 12 17 ar 14 12 13 ar 15 13 14 ar 16 14 15 ar 17 15 16 ar 18 16 17 ar 19 1 18 1 20 3 19 1 21 4 20 1 22 5 21 1 23 6 22 1 24 13 23 1 25 14 24 1 26 15 25 1 27 16 26 1 28 17 27 1