@MOLECULE FDBD02004 28 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0187 1.5258 0.0104 C.3 1 UNK -0.0215 2 C1 0.0021 -0.0041 0.0020 C.3 1 UNK 0.1235 3 C2 -1.4351 -0.5282 0.0262 C.3 1 UNK -0.0215 4 C3 0.6841 -0.4846 -1.2516 C.2 1 UNK -0.0409 5 C4 2.0029 -0.6676 -1.2645 C.2 1 UNK -0.0513 6 C5 2.7548 -0.3984 -0.0202 C.ar 1 UNK 0.0168 7 C6 4.1360 -0.2350 -0.0277 C.ar 1 UNK -0.0477 8 C7 4.7997 0.0151 1.1564 C.ar 1 UNK -0.0192 9 C8 4.0934 0.1029 2.3497 C.ar 1 UNK 0.1236 10 C9 2.7146 -0.0586 2.3639 C.ar 1 UNK 0.0224 11 C10 2.0411 -0.3091 1.1843 C.ar 1 UNK 0.1323 12 O 0.6937 -0.4721 1.1606 O.3 1 UNK -0.4815 13 O1 4.7562 0.3488 3.5099 O.3 1 UNK -0.4950 14 C11 6.1742 0.5055 3.4263 C.3 1 UNK 0.0788 15 H -0.5027 1.8710 0.9000 H 1 UNK 0.0271 16 H1 -0.5527 1.8800 -0.8465 H 1 UNK 0.0271 17 H2 0.9848 1.8963 -0.0164 H 1 UNK 0.0271 18 H3 -1.9235 -0.1889 0.9157 H 1 UNK 0.0271 19 H4 -1.4249 -1.5980 0.0108 H 1 UNK 0.0271 20 H5 -1.9620 -0.1642 -0.8310 H 1 UNK 0.0271 21 H6 0.1291 -0.6722 -2.1012 H 1 UNK 0.0611 22 H7 2.4862 -0.9880 -2.1182 H 1 UNK 0.0623 23 H8 4.6615 -0.3004 -0.9134 H 1 UNK 0.0626 24 H9 5.8244 0.1373 1.1554 H 1 UNK 0.0654 25 H10 2.1946 0.0083 3.2528 H 1 UNK 0.0691 26 H11 6.5705 0.6932 4.4023 H 1 UNK 0.0660 27 H12 6.4047 1.3291 2.7833 H 1 UNK 0.0660 28 H13 6.6091 -0.3885 3.0306 H 1 UNK 0.0660 @BOND 1 1 2 1 2 2 12 1 3 2 3 1 4 2 4 1 5 4 5 2 6 5 6 1 7 6 11 ar 8 6 7 ar 9 7 8 ar 10 8 9 ar 11 9 10 ar 12 9 13 1 13 10 11 ar 14 11 12 1 15 13 14 1 16 1 15 1 17 1 16 1 18 1 17 1 19 3 18 1 20 3 19 1 21 3 20 1 22 4 21 1 23 5 22 1 24 7 23 1 25 8 24 1 26 10 25 1 27 14 26 1 28 14 27 1 29 14 28 1