@MOLECULE FDBD02322 42 45 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0132 1.3664 -0.2886 C.ar 1 UNK -0.0435 2 C1 1.2006 2.0502 -0.2916 C.ar 1 UNK 0.0032 3 C2 2.3661 1.3507 -0.2058 C.ar 1 UNK 0.1869 4 N 2.3710 0.0171 -0.1185 N.ar 1 UNK -0.0684 5 C3 1.2284 -0.6750 -0.1120 C.ar 1 UNK 0.4496 6 C4 0.0045 -0.0104 -0.1980 C.ar 1 UNK 0.0813 7 N1 1.2317 -2.0525 -0.0205 N.pl3 1 UNK -0.1216 8 C5 -0.0377 -2.7837 -0.0150 C.3 1 UNK 0.1772 9 C6 -0.4250 -3.1285 -1.4300 C.ar 1 UNK 0.0528 10 C7 -1.1954 -2.2597 -2.1867 C.ar 1 UNK 0.0399 11 N2 -1.5160 -2.5962 -3.4257 N.ar 1 UNK -0.2432 12 C8 -1.1122 -3.7402 -3.9406 C.ar 1 UNK 0.1159 13 N3 -0.3786 -4.5907 -3.2510 N.ar 1 UNK -0.2432 14 C9 -0.0145 -4.3194 -2.0080 C.ar 1 UNK 0.0399 15 C10 2.3938 -2.7297 0.0633 C.2 1 UNK 0.1293 16 O 2.3973 -3.9458 0.1434 O.co2 1 UNK -0.7759 17 C11 3.6135 -2.0042 0.0565 C.2 1 UNK 0.1478 18 C12 4.9116 -2.7118 0.1465 C.ar 1 UNK -0.0028 19 C13 5.8092 -2.6666 -0.9202 C.ar 1 UNK -0.0535 20 C14 7.0170 -3.3274 -0.8303 C.ar 1 UNK -0.0606 21 C15 7.3384 -4.0343 0.3150 C.ar 1 UNK -0.0501 22 C16 6.4525 -4.0828 1.3761 C.ar 1 UNK 0.0554 23 C17 5.2437 -3.4212 1.3003 C.ar 1 UNK -0.0419 24 C18 6.8101 -4.8554 2.6196 C.3 1 UNK 0.4174 25 F 8.0759 -5.4304 2.4634 F 1 UNK -0.1659 26 F1 6.8235 -3.9899 3.7187 F 1 UNK -0.1659 27 F2 5.8630 -5.8631 2.8311 F 1 UNK -0.1659 28 C19 3.5691 -0.6240 -0.0353 C.2 1 UNK 0.4373 29 O1 4.7176 0.0888 -0.0442 O.2 1 UNK -0.2124 30 H -0.9067 1.8788 -0.3528 H 1 UNK 0.0624 31 H1 1.2165 3.0799 -0.3584 H 1 UNK 0.0677 32 H2 3.2633 1.8606 -0.2082 H 1 UNK 0.1384 33 H3 -0.8791 -0.5435 -0.1939 H 1 UNK 0.0751 34 H4 -0.7989 -2.1735 0.4245 H 1 UNK 0.1081 35 H5 0.0713 -3.6832 0.5542 H 1 UNK 0.1081 36 H6 -1.5147 -1.3624 -1.7892 H 1 UNK 0.0835 37 H7 -1.3775 -3.9763 -4.9096 H 1 UNK 0.1047 38 H8 0.5672 -4.9856 -1.4762 H 1 UNK 0.0835 39 H9 5.5704 -2.1399 -1.7750 H 1 UNK 0.0624 40 H10 7.6820 -3.2944 -1.6188 H 1 UNK 0.0618 41 H11 8.2428 -4.5274 0.3777 H 1 UNK 0.0623 42 H12 4.5869 -3.4514 2.0958 H 1 UNK 0.0629 @BOND 1 1 6 ar 2 1 2 ar 3 2 3 ar 4 3 4 ar 5 4 28 am 6 4 5 ar 7 5 6 ar 8 5 7 1 9 7 8 1 10 7 15 1 11 8 9 1 12 9 14 ar 13 9 10 ar 14 10 11 ar 15 11 12 ar 16 12 13 ar 17 13 14 ar 18 15 16 0 19 15 17 2 20 17 18 1 21 17 28 0 22 18 23 ar 23 18 19 ar 24 19 20 ar 25 20 21 ar 26 21 22 ar 27 22 23 ar 28 22 24 1 29 24 25 1 30 24 26 1 31 24 27 1 32 28 29 2 33 1 30 1 34 2 31 1 35 3 32 1 36 6 33 1 37 8 34 1 38 8 35 1 39 10 36 1 40 12 37 1 41 14 38 1 42 19 39 1 43 20 40 1 44 21 41 1 45 23 42 1