@MOLECULE FDBD03055 37 40 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0167 1.3780 0.0096 C.ar 1 UNK -0.0613 2 C1 1.1709 2.0861 0.0021 C.ar 1 UNK -0.0604 3 C2 2.3773 1.4123 -0.0135 C.ar 1 UNK -0.0430 4 C3 2.3967 0.0287 -0.0210 C.ar 1 UNK 0.0467 5 C4 1.2083 -0.6792 -0.0130 C.ar 1 UNK 0.0028 6 C5 0.0021 -0.0041 0.0020 C.ar 1 UNK -0.0546 7 C6 1.2286 -2.1860 -0.0218 C.3 1 UNK 0.1257 8 C7 1.3104 -2.8900 -1.3777 C.3 1 UNK 0.1861 9 C8 1.3660 -2.0163 -2.6324 C.3 1 UNK 0.2132 10 N 1.4408 -2.8712 -3.8198 N.ar 1 UNK -0.0681 11 C9 0.6177 -2.8480 -4.8824 C.ar 1 UNK 0.2726 12 N1 1.0190 -3.7631 -5.7269 N.ar 1 UNK -0.2928 13 C10 2.0906 -4.3882 -5.2405 C.ar 1 UNK 0.1651 14 N2 2.3903 -3.8735 -4.0769 N.ar 1 UNK 0.0139 15 C11 2.0730 -4.1878 -1.4502 C.ar 1 UNK -0.0066 16 C12 3.1341 -4.4141 -0.5935 C.ar 1 UNK -0.0528 17 C13 3.8339 -5.6041 -0.6587 C.ar 1 UNK -0.0261 18 C14 3.4719 -6.5697 -1.5826 C.ar 1 UNK 0.1234 19 C15 2.4089 -6.3419 -2.4401 C.ar 1 UNK -0.0261 20 C16 1.7073 -5.1534 -2.3695 C.ar 1 UNK -0.0528 21 F 4.1556 -7.7331 -1.6476 F 1 UNK -0.2055 22 O 0.1105 -2.8636 -0.5987 O.3 1 UNK -0.3481 23 Cl 3.9119 -0.8184 -0.0411 Cl 1 UNK -0.0832 24 H -0.9174 1.8816 0.0209 H 1 UNK 0.0618 25 H1 1.1563 3.1180 0.0082 H 1 UNK 0.0618 26 H2 3.2636 1.9409 -0.0196 H 1 UNK 0.0632 27 H3 -0.8846 -0.5321 0.0075 H 1 UNK 0.0622 28 H4 1.7636 -2.2333 0.9036 H 1 UNK 0.0682 29 H5 2.2305 -1.3871 -2.5909 H 1 UNK 0.1090 30 H6 0.4858 -1.4101 -2.6842 H 1 UNK 0.1090 31 H7 -0.1899 -2.2182 -5.0098 H 1 UNK 0.1623 32 H8 0.5930 -3.9604 -6.5923 H 1 UNK 0.1720 33 H9 2.6011 -5.1544 -5.7068 H 1 UNK 0.1090 34 H10 3.4038 -3.6942 0.0950 H 1 UNK 0.0622 35 H11 4.6259 -5.7729 -0.0190 H 1 UNK 0.0646 36 H12 2.1407 -7.0594 -3.1317 H 1 UNK 0.0646 37 H13 0.9101 -4.9866 -3.0033 H 1 UNK 0.0622 @BOND 1 1 6 ar 2 1 2 ar 3 2 3 ar 4 3 4 ar 5 4 5 ar 6 4 23 1 7 5 6 ar 8 5 7 1 9 7 22 1 10 7 8 1 11 8 9 1 12 8 15 1 13 8 22 1 14 9 10 1 15 10 14 ar 16 10 11 ar 17 11 12 ar 18 12 13 ar 19 13 14 ar 20 15 20 ar 21 15 16 ar 22 16 17 ar 23 17 18 ar 24 18 19 ar 25 18 21 1 26 19 20 ar 27 1 24 1 28 2 25 1 29 3 26 1 30 6 27 1 31 7 28 1 32 9 29 1 33 9 30 1 34 11 31 1 35 12 32 1 36 13 33 1 37 16 34 1 38 17 35 1 39 19 36 1 40 20 37 1