@MOLECULE FDBD02901 46 48 0 0 0 SMALL USER_CHARGES @ATOM 1 C 8.4357 -3.4709 -3.5711 C.ar 1 UNK -0.0617 2 C1 7.3818 -4.2397 -3.1139 C.ar 1 UNK -0.0615 3 C2 6.4654 -3.7006 -2.2304 C.ar 1 UNK -0.0580 4 C3 6.6032 -2.3930 -1.8039 C.ar 1 UNK -0.0364 5 C4 7.6576 -1.6245 -2.2604 C.ar 1 UNK -0.0580 6 C5 8.5732 -2.1631 -3.1450 C.ar 1 UNK -0.0615 7 C6 5.6036 -1.8050 -0.8415 C.3 1 UNK 0.0724 8 C7 6.0640 -2.0492 0.5725 C.2 1 UNK 0.3059 9 O 7.1015 -2.6423 0.7785 O.2 1 UNK -0.2473 10 N 5.3226 -1.6085 1.6082 N.am 1 UNK -0.1667 11 C8 5.6871 -1.9300 2.9101 C.cat 1 UNK 0.3749 12 N1 5.0171 -1.4426 3.9119 N.2 1 UNK 0.1545 13 O1 3.9849 -0.5008 3.6821 O.2 1 UNK -0.2959 14 C9 3.3337 -0.0503 4.8717 C.3 1 UNK 0.1467 15 C10 2.2430 0.9582 4.5053 C.3 1 UNK -0.0019 16 C11 0.7950 0.5789 4.8221 C.3 1 UNK -0.0466 17 C12 1.5050 1.6489 5.6538 C.3 1 UNK -0.0466 18 C13 6.8376 -2.8269 3.1561 C.ar 1 UNK 0.1194 19 C14 8.1196 -2.2968 3.3075 C.ar 1 UNK 0.0728 20 C15 9.1890 -3.1368 3.5371 C.ar 1 UNK -0.0464 21 C16 8.9955 -4.5048 3.6176 C.ar 1 UNK -0.0230 22 C17 7.7277 -5.0404 3.4689 C.ar 1 UNK 0.1593 23 C18 6.6445 -4.2071 3.2436 C.ar 1 UNK 0.1739 24 F 5.4068 -4.7288 3.0987 F 1 UNK -0.2016 25 F1 7.5461 -6.3768 3.5482 F 1 UNK -0.2025 26 C19 8.3353 -0.8079 3.2196 C.3 1 UNK 0.4183 27 F2 9.6925 -0.5217 3.4021 F 1 UNK -0.1659 28 F3 7.9274 -0.3510 1.9617 F 1 UNK -0.1659 29 F4 7.5862 -0.1687 4.2133 F 1 UNK -0.1659 30 H 9.1199 -3.8733 -4.2306 H 1 UNK 0.0618 31 H1 7.2791 -5.2160 -3.4321 H 1 UNK 0.0618 32 H2 5.6784 -4.2744 -1.8893 H 1 UNK 0.0620 33 H3 7.7613 -0.6487 -1.9408 H 1 UNK 0.0620 34 H4 9.3594 -1.5888 -3.4873 H 1 UNK 0.0618 35 H5 4.6502 -2.2671 -0.9910 H 1 UNK 0.0430 36 H6 5.5204 -0.7521 -1.0127 H 1 UNK 0.0430 37 H7 4.5228 -1.0588 1.4424 H 1 UNK 0.3014 38 H8 4.0497 0.4167 5.5152 H 1 UNK 0.0750 39 H9 2.8929 -0.8853 5.3751 H 1 UNK 0.0750 40 H10 2.7650 1.2904 3.6323 H 1 UNK 0.0335 41 H11 0.5740 -0.3749 5.2537 H 1 UNK 0.0269 42 H12 -0.1159 0.5366 4.2623 H 1 UNK 0.0269 43 H13 1.2164 2.6753 5.5638 H 1 UNK 0.0269 44 H14 1.6952 1.7938 6.6967 H 1 UNK 0.0269 45 H15 10.1367 -2.7440 3.6493 H 1 UNK 0.0624 46 H16 9.7998 -5.1283 3.7892 H 1 UNK 0.0647 @BOND 1 1 6 ar 2 1 2 ar 3 2 3 ar 4 3 4 ar 5 4 5 ar 6 4 7 1 7 5 6 ar 8 7 8 1 9 8 9 2 10 8 10 am 11 10 11 1 12 11 12 2 13 11 18 1 14 12 13 1 15 13 14 1 16 14 15 1 17 15 17 1 18 15 16 1 19 16 17 1 20 18 23 ar 21 18 19 ar 22 19 20 ar 23 19 26 1 24 20 21 ar 25 21 22 ar 26 22 23 ar 27 22 25 1 28 23 24 1 29 26 27 1 30 26 28 1 31 26 29 1 32 1 30 1 33 2 31 1 34 3 32 1 35 5 33 1 36 6 34 1 37 7 35 1 38 7 36 1 39 10 37 1 40 14 38 1 41 14 39 1 42 15 40 1 43 16 41 1 44 16 42 1 45 17 43 1 46 17 44 1 47 20 45 1 48 21 46 1