@MOLECULE FDBD02282 39 39 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.0227 1.4930 0.0307 C.3 1 UNK -0.0618 2 C1 0.0146 -0.0370 0.0207 C.3 1 UNK -0.0372 3 C2 -1.4089 -0.5317 0.0161 C.2 1 UNK -0.0808 4 C3 -1.8393 -1.2793 -0.9698 C.2 1 UNK -0.0225 5 C4 -0.9564 -1.5322 -2.1646 C.3 1 UNK -0.0393 6 C5 -3.2173 -1.8864 -0.9091 C.3 1 UNK 0.2086 7 C6 -4.0525 -1.3155 -1.9783 C.1 1 UNK 0.1119 8 N -4.6971 -0.8748 -2.8035 N.1 1 UNK -0.1923 9 O -3.1209 -3.3243 -1.0859 O.3 1 UNK -0.4415 10 C7 -4.0529 -4.0767 -0.4800 C.2 1 UNK 0.3129 11 O1 -4.9205 -3.5511 0.1764 O.2 1 UNK -0.2504 12 C8 -4.0171 -5.5769 -0.6184 C.3 1 UNK 0.0689 13 C9 -3.6728 -6.3934 0.6289 C.3 1 UNK -0.0011 14 C10 -3.3954 -5.6358 1.9018 C.2 1 UNK -0.0499 15 C11 -2.9319 -6.2689 2.9550 C.2 1 UNK 0.1029 16 Cl -2.6386 -7.9783 2.8808 Cl 1 UNK -0.0708 17 Cl1 -2.6124 -5.3962 4.4213 Cl 1 UNK -0.0708 18 C12 -5.1070 -6.3784 0.0961 C.3 1 UNK -0.0143 19 C13 -6.1498 -5.5955 0.8965 C.3 1 UNK -0.0585 20 C14 -5.6181 -7.6456 -0.5923 C.3 1 UNK -0.0585 21 H 1.0334 1.8443 0.0340 H 1 UNK 0.0233 22 H1 -0.4806 1.8466 0.9062 H 1 UNK 0.0233 23 H2 -0.4790 1.8580 -0.8411 H 1 UNK 0.0233 24 H3 0.5163 -0.4020 0.8925 H 1 UNK 0.0305 25 H4 0.5180 -0.3907 -0.8548 H 1 UNK 0.0305 26 H5 -2.0446 -0.2815 0.7896 H 1 UNK 0.0573 27 H6 -0.0235 -1.0250 -2.0325 H 1 UNK 0.0276 28 H7 -1.4384 -1.1680 -3.0477 H 1 UNK 0.0276 29 H8 -0.7804 -2.5831 -2.2619 H 1 UNK 0.0276 30 H9 -3.6596 -1.6728 0.0415 H 1 UNK 0.0945 31 H10 -3.6444 -5.5317 -1.6204 H 1 UNK 0.0425 32 H11 -2.9594 -7.1563 0.8614 H 1 UNK 0.0357 33 H12 -3.5696 -4.6196 1.9459 H 1 UNK 0.0598 34 H13 -5.6905 -4.7337 1.3338 H 1 UNK 0.0235 35 H14 -6.5475 -6.2189 1.6699 H 1 UNK 0.0235 36 H15 -6.9407 -5.2864 0.2455 H 1 UNK 0.0235 37 H16 -4.8139 -8.1136 -1.1207 H 1 UNK 0.0235 38 H17 -6.3956 -7.3885 -1.2810 H 1 UNK 0.0235 39 H18 -6.0023 -8.3209 0.1434 H 1 UNK 0.0235 @BOND 1 1 2 1 2 2 3 1 3 3 4 2 4 4 5 1 5 4 6 1 6 6 7 1 7 6 9 1 8 7 8 3 9 9 10 1 10 10 11 2 11 10 12 1 12 12 18 1 13 12 13 1 14 13 14 1 15 13 18 1 16 14 15 2 17 15 16 1 18 15 17 1 19 18 19 1 20 18 20 1 21 1 21 1 22 1 22 1 23 1 23 1 24 2 24 1 25 2 25 1 26 3 26 1 27 5 27 1 28 5 28 1 29 5 29 1 30 6 30 1 31 12 31 1 32 13 32 1 33 14 33 1 34 19 34 1 35 19 35 1 36 19 36 1 37 20 37 1 38 20 38 1 39 20 39 1