@MOLECULE FDBD01233 43 43 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.1533 -0.7351 -1.3375 O.3 1 UNK -0.4855 2 O1 -2.0783 0.3011 -3.0557 O.3 1 UNK -0.3831 3 O2 1.6580 0.8653 0.0354 O.3 1 UNK -0.4843 4 N -3.0290 0.1149 0.5181 N.4 1 UNK 0.2307 5 C -2.6648 0.7023 -0.7641 C.3 1 UNK -0.0035 6 C1 -2.4692 -0.3597 -1.8487 C.3 1 UNK 0.1285 7 C2 -3.1536 1.1410 1.5444 C.3 1 UNK -0.0283 8 C3 -1.4050 -1.3962 -1.4953 C.3 1 UNK 0.1206 9 C4 -1.8334 1.8889 1.7077 C.3 1 UNK -0.0219 10 C5 -3.5840 0.4957 2.8579 C.3 1 UNK -0.0219 11 C6 0.7258 -1.2871 -0.4447 C.ar 1 UNK 0.1620 12 C7 1.6309 -0.4812 0.2391 C.ar 1 UNK 0.1624 13 C8 0.7028 -2.6619 -0.2311 C.ar 1 UNK -0.0163 14 C9 2.5215 -1.0561 1.1458 C.ar 1 UNK -0.0163 15 C10 1.5934 -3.2365 0.6757 C.ar 1 UNK -0.0581 16 C11 2.5027 -2.4336 1.3640 C.ar 1 UNK -0.0581 17 C12 2.9140 1.5206 0.2003 C.3 1 UNK 0.1077 18 C13 2.9819 2.6727 -0.7464 C.2 1 UNK -0.0542 19 C14 3.1396 3.9449 -0.3649 C.2 1 UNK -0.0995 20 H -2.7462 0.9634 -3.2926 H 1 UNK 0.2102 21 H1 -2.3081 -0.5505 0.7972 H 1 UNK 0.2017 22 H2 -3.9285 -0.3552 0.4170 H 1 UNK 0.2017 23 H3 -1.7519 1.2480 -0.6468 H 1 UNK 0.0841 24 H4 -3.4638 1.3442 -1.0715 H 1 UNK 0.0841 25 H5 -3.3957 -0.8844 -1.9546 H 1 UNK 0.0681 26 H6 -3.8983 1.8511 1.2509 H 1 UNK 0.0845 27 H7 -1.6701 -1.8865 -0.5820 H 1 UNK 0.0725 28 H8 -1.3348 -2.1251 -2.2755 H 1 UNK 0.0725 29 H9 -1.0680 1.2014 2.0018 H 1 UNK 0.0284 30 H10 -1.9418 2.6443 2.4577 H 1 UNK 0.0284 31 H11 -1.5647 2.3454 0.7780 H 1 UNK 0.0284 32 H12 -2.8471 -0.2175 3.1632 H 1 UNK 0.0284 33 H13 -4.5234 0.0019 2.7217 H 1 UNK 0.0284 34 H14 -3.6834 1.2501 3.6102 H 1 UNK 0.0284 35 H15 0.0293 -3.2542 -0.7417 H 1 UNK 0.0655 36 H16 3.1944 -0.4622 1.6552 H 1 UNK 0.0655 37 H17 1.5795 -4.2557 0.8373 H 1 UNK 0.0619 38 H18 3.1617 -2.8588 2.0348 H 1 UNK 0.0619 39 H19 3.7080 0.8348 -0.0099 H 1 UNK 0.0742 40 H20 3.0130 1.8700 1.2068 H 1 UNK 0.0742 41 H21 2.9024 2.4757 -1.7563 H 1 UNK 0.0600 42 H22 3.2224 4.1766 0.6373 H 1 UNK 0.0533 43 H23 3.1785 4.6948 -1.0728 H 1 UNK 0.0533 @BOND 1 1 8 1 2 1 11 1 3 2 6 1 4 3 12 1 5 3 17 1 6 4 5 1 7 4 7 1 8 5 6 1 9 6 8 1 10 7 9 1 11 7 10 1 12 11 12 ar 13 11 13 ar 14 12 14 ar 15 13 15 ar 16 14 16 ar 17 15 16 ar 18 17 18 1 19 18 19 2 20 2 20 1 21 4 21 1 22 4 22 1 23 5 23 1 24 5 24 1 25 6 25 1 26 7 26 1 27 8 27 1 28 8 28 1 29 9 29 1 30 9 30 1 31 9 31 1 32 10 32 1 33 10 33 1 34 10 34 1 35 13 35 1 36 14 36 1 37 15 37 1 38 16 38 1 39 17 39 1 40 17 40 1 41 18 41 1 42 19 42 1 43 19 43 1