@MOLECULE FDBD02285 46 48 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.1958 -3.2468 -0.8449 C.3 1 UNK -0.0585 2 C1 0.7012 -4.5766 -0.2820 C.3 1 UNK -0.0143 3 C2 -0.1672 -5.7974 -0.5926 C.3 1 UNK -0.0585 4 C3 2.2154 -4.7851 -0.2140 C.3 1 UNK -0.0011 5 C4 2.7378 -6.1773 -0.4589 C.2 1 UNK -0.0499 6 C5 3.5675 -6.4021 -1.4518 C.2 1 UNK 0.1029 7 Cl 4.0624 -5.0955 -2.4822 Cl 1 UNK -0.0708 8 Cl1 4.1693 -8.0058 -1.7339 Cl 1 UNK -0.0708 9 C6 1.4179 -4.5449 1.0694 C.3 1 UNK 0.0689 10 C7 1.5723 -3.2064 1.7444 C.2 1 UNK 0.3116 11 O 1.1378 -2.2101 1.2169 O.2 1 UNK -0.2505 12 O1 2.1927 -3.1211 2.9317 O.3 1 UNK -0.4596 13 C8 2.3052 -1.7999 3.5232 C.3 1 UNK 0.1176 14 C9 3.0250 -1.9002 4.8434 C.ar 1 UNK -0.0068 15 C10 2.3080 -2.1128 6.0067 C.ar 1 UNK -0.0551 16 C11 2.9653 -2.2058 7.2194 C.ar 1 UNK -0.0579 17 C12 4.3407 -2.0859 7.2721 C.ar 1 UNK -0.0193 18 C13 5.0623 -1.8726 6.1065 C.ar 1 UNK 0.1288 19 C14 4.4006 -1.7853 4.8898 C.ar 1 UNK -0.0129 20 O2 6.4151 -1.7543 6.1556 O.3 1 UNK -0.4560 21 C15 7.0699 -1.4387 5.0075 C.ar 1 UNK 0.1284 22 C16 7.2705 -0.1092 4.6648 C.ar 1 UNK -0.0193 23 C17 7.9364 0.2089 3.4971 C.ar 1 UNK -0.0583 24 C18 8.4026 -0.7962 2.6699 C.ar 1 UNK -0.0615 25 C19 8.2037 -2.1219 3.0089 C.ar 1 UNK -0.0583 26 C20 7.5442 -2.4454 4.1787 C.ar 1 UNK -0.0193 27 H -0.8741 -3.2382 -0.8335 H 1 UNK 0.0235 28 H1 0.5427 -3.1302 -1.8504 H 1 UNK 0.0235 29 H2 0.5654 -2.4419 -0.2445 H 1 UNK 0.0235 30 H3 -1.1971 -5.5077 -0.6089 H 1 UNK 0.0235 31 H4 -0.0181 -6.5422 0.1610 H 1 UNK 0.0235 32 H5 0.1063 -6.1961 -1.5471 H 1 UNK 0.0235 33 H6 3.0645 -4.3252 -0.6749 H 1 UNK 0.0357 34 H7 2.4436 -6.9540 0.1536 H 1 UNK 0.0598 35 H8 1.3047 -5.0631 1.9987 H 1 UNK 0.0425 36 H9 1.3273 -1.3949 3.6800 H 1 UNK 0.0749 37 H10 2.8549 -1.1601 2.8649 H 1 UNK 0.0749 38 H11 1.2806 -2.2022 5.9695 H 1 UNK 0.0621 39 H12 2.4281 -2.3649 8.0861 H 1 UNK 0.0619 40 H13 4.8308 -2.1549 8.1777 H 1 UNK 0.0654 41 H14 4.9359 -1.6347 4.0204 H 1 UNK 0.0658 42 H15 6.9225 0.6413 5.2818 H 1 UNK 0.0654 43 H16 8.0861 1.1976 3.2419 H 1 UNK 0.0619 44 H17 8.8999 -0.5565 1.7980 H 1 UNK 0.0618 45 H18 8.5483 -2.8703 2.3874 H 1 UNK 0.0619 46 H19 7.4044 -3.4350 4.4360 H 1 UNK 0.0654 @BOND 1 1 2 1 2 2 9 1 3 2 3 1 4 2 4 1 5 4 5 1 6 4 9 1 7 5 6 2 8 6 7 1 9 6 8 1 10 9 10 1 11 10 11 2 12 10 12 1 13 12 13 1 14 13 14 1 15 14 19 ar 16 14 15 ar 17 15 16 ar 18 16 17 ar 19 17 18 ar 20 18 19 ar 21 18 20 1 22 20 21 1 23 21 26 ar 24 21 22 ar 25 22 23 ar 26 23 24 ar 27 24 25 ar 28 25 26 ar 29 1 27 1 30 1 28 1 31 1 29 1 32 3 30 1 33 3 31 1 34 3 32 1 35 4 33 1 36 5 34 1 37 9 35 1 38 13 36 1 39 13 37 1 40 15 38 1 41 16 39 1 42 17 40 1 43 19 41 1 44 22 42 1 45 23 43 1 46 24 44 1 47 25 45 1 48 26 46 1