@MOLECULE FDBD02270 57 59 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.0180 1.4142 -0.2930 C.3 1 UNK -0.0605 2 C1 -0.9573 -0.1143 -0.3235 C.3 1 UNK -0.0179 3 C2 -0.3864 -0.6285 0.9996 C.3 1 UNK -0.0605 4 C3 -2.3659 -0.6767 -0.5241 C.3 1 UNK 0.1209 5 C4 -2.9210 -0.1849 -1.8360 C.2 1 UNK 0.3294 6 O -3.9351 0.4718 -1.8547 O.2 1 UNK -0.2487 7 O1 -2.2890 -0.4764 -2.9837 O.3 1 UNK -0.4401 8 C5 -2.8806 0.0302 -4.2091 C.3 1 UNK 0.2129 9 C6 -2.3304 1.3630 -4.5052 C.1 1 UNK 0.1123 10 N -1.9058 2.3916 -4.7336 N.1 1 UNK -0.1923 11 C7 -2.5635 -0.9079 -5.3452 C.ar 1 UNK 0.0103 12 C8 -1.3488 -1.5681 -5.3775 C.ar 1 UNK -0.0538 13 C9 -1.0550 -2.4296 -6.4180 C.ar 1 UNK -0.0579 14 C10 -1.9746 -2.6328 -7.4288 C.ar 1 UNK -0.0193 15 C11 -3.1939 -1.9717 -7.3989 C.ar 1 UNK 0.1288 16 C12 -3.4886 -1.1118 -6.3503 C.ar 1 UNK -0.0116 17 O2 -4.1001 -2.1697 -8.3919 O.3 1 UNK -0.4560 18 C13 -5.2280 -1.4120 -8.3867 C.ar 1 UNK 0.1284 19 C14 -5.1776 -0.0878 -8.7980 C.ar 1 UNK -0.0193 20 C15 -6.3257 0.6803 -8.7916 C.ar 1 UNK -0.0583 21 C16 -7.5244 0.1308 -8.3755 C.ar 1 UNK -0.0615 22 C17 -7.5773 -1.1884 -7.9648 C.ar 1 UNK -0.0583 23 C18 -6.4334 -1.9628 -7.9755 C.ar 1 UNK -0.0193 24 N1 -3.2308 -0.2295 0.5705 N.pl3 1 UNK -0.3301 25 C19 -4.3940 -0.9407 0.8772 C.ar 1 UNK 0.0463 26 C20 -4.7832 -2.0132 0.0854 C.ar 1 UNK -0.0389 27 C21 -5.9331 -2.7144 0.3914 C.ar 1 UNK -0.0483 28 C22 -6.6975 -2.3497 1.4847 C.ar 1 UNK 0.0563 29 C23 -6.3136 -1.2825 2.2757 C.ar 1 UNK -0.0300 30 C24 -5.1611 -0.5799 1.9787 C.ar 1 UNK 0.0623 31 Cl -4.6794 0.7599 2.9720 Cl 1 UNK -0.0816 32 C25 -7.9520 -3.1169 1.8145 C.3 1 UNK 0.4175 33 F -7.6399 -4.1717 2.6788 F 1 UNK -0.1659 34 F1 -8.8715 -2.2633 2.4334 F 1 UNK -0.1659 35 F2 -8.5091 -3.6278 0.6373 F 1 UNK -0.1659 36 H -0.0329 1.8075 -0.1527 H 1 UNK 0.0233 37 H1 -1.6464 1.7302 0.5133 H 1 UNK 0.0233 38 H2 -1.4172 1.7738 -1.2183 H 1 UNK 0.0233 39 H3 -0.3289 -0.4303 -1.1299 H 1 UNK 0.0319 40 H4 -1.0147 -0.3125 1.8060 H 1 UNK 0.0233 41 H5 0.5988 -0.2352 1.1398 H 1 UNK 0.0233 42 H6 -0.3440 -1.6974 0.9783 H 1 UNK 0.0233 43 H7 -2.3252 -1.7459 -0.5324 H 1 UNK 0.0616 44 H8 -3.9416 0.1007 -4.0903 H 1 UNK 0.0948 45 H9 -0.6604 -1.4174 -4.6235 H 1 UNK 0.0622 46 H10 -0.1480 -2.9214 -6.4397 H 1 UNK 0.0619 47 H11 -1.7547 -3.2758 -8.2054 H 1 UNK 0.0654 48 H12 -4.3982 -0.6251 -6.3215 H 1 UNK 0.0658 49 H13 -4.2832 0.3229 -9.1084 H 1 UNK 0.0654 50 H14 -6.2888 1.6652 -9.0977 H 1 UNK 0.0619 51 H15 -8.3810 0.7063 -8.3715 H 1 UNK 0.0618 52 H16 -8.4721 -1.5949 -7.6500 H 1 UNK 0.0619 53 H17 -6.4753 -2.9501 -7.6779 H 1 UNK 0.0654 54 H18 -2.9926 0.5721 1.0900 H 1 UNK 0.1469 55 H19 -4.2137 -2.2860 -0.7309 H 1 UNK 0.0637 56 H20 -6.2223 -3.5116 -0.1966 H 1 UNK 0.0624 57 H21 -6.8882 -1.0104 3.0886 H 1 UNK 0.0638 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 4 5 1 5 4 24 1 6 5 6 2 7 5 7 1 8 7 8 1 9 8 9 1 10 8 11 1 11 9 10 3 12 11 16 ar 13 11 12 ar 14 12 13 ar 15 13 14 ar 16 14 15 ar 17 15 16 ar 18 15 17 1 19 17 18 1 20 18 23 ar 21 18 19 ar 22 19 20 ar 23 20 21 ar 24 21 22 ar 25 22 23 ar 26 24 25 1 27 25 30 ar 28 25 26 ar 29 26 27 ar 30 27 28 ar 31 28 29 ar 32 28 32 1 33 29 30 ar 34 30 31 1 35 32 33 1 36 32 34 1 37 32 35 1 38 1 36 1 39 1 37 1 40 1 38 1 41 2 39 1 42 3 40 1 43 3 41 1 44 3 42 1 45 4 43 1 46 8 44 1 47 12 45 1 48 13 46 1 49 14 47 1 50 16 48 1 51 19 49 1 52 20 50 1 53 21 51 1 54 22 52 1 55 23 53 1 56 24 54 1 57 26 55 1 58 27 56 1 59 29 57 1