@MOLECULE FDBD00396 55 56 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.5524 -1.3311 -0.1336 O.3 1 UNK -0.4763 2 O1 -1.6824 0.1783 -1.7485 O.2 1 UNK -0.2702 3 N -5.3488 -1.4112 0.4884 N.4 1 UNK 0.2359 4 N1 -1.6487 -1.1759 0.1335 N.am 1 UNK -0.3063 5 N2 2.9167 0.8907 0.0711 N.ar 1 UNK -0.2129 6 C -4.0135 -0.8623 0.6866 C.3 1 UNK -0.0160 7 C1 -2.9782 -1.7192 -0.0271 C.3 1 UNK 0.0520 8 C2 -6.2640 -0.9305 1.5255 C.3 1 UNK -0.0348 9 C3 -5.8588 -1.0619 -0.8390 C.3 1 UNK -0.0348 10 C4 0.2796 0.1833 -0.4642 C.ar 1 UNK 0.0509 11 C5 -6.4232 0.5790 1.4605 C.3 1 UNK -0.0245 12 C6 -7.2229 -1.6841 -1.0844 C.3 1 UNK -0.0245 13 C7 0.6101 1.5235 -0.2225 C.ar 1 UNK 0.0127 14 C8 -1.0842 -0.2520 -0.7498 C.2 1 UNK 0.2450 15 C9 1.9592 1.8371 0.0445 C.ar 1 UNK 0.0755 16 C10 1.2640 -0.7941 -0.4376 C.ar 1 UNK 0.0127 17 C11 5.8256 -2.0431 0.1224 C.3 1 UNK -0.0188 18 C12 2.5560 -0.3911 -0.1674 C.ar 1 UNK 0.2160 19 C13 4.8654 -0.8622 0.1491 C.3 1 UNK 0.0912 20 C14 7.2561 -1.6132 0.4346 C.3 1 UNK -0.0528 21 C15 -0.3635 2.5367 -0.2423 C.ar 1 UNK -0.0518 22 C16 2.2870 3.1685 0.2846 C.ar 1 UNK -0.0356 23 C17 -0.0077 3.8601 0.0013 C.ar 1 UNK -0.0611 24 C18 1.3193 4.1761 0.2649 C.ar 1 UNK -0.0597 25 C19 8.2043 -2.8015 0.4494 C.3 1 UNK -0.0652 26 H -5.2874 -2.4271 0.5555 H 1 UNK 0.2034 27 H1 -1.1133 -1.4719 0.9048 H 1 UNK 0.1492 28 H2 -3.7927 -0.8407 1.7333 H 1 UNK 0.0830 29 H3 -3.9817 0.1287 0.2844 H 1 UNK 0.0830 30 H4 -3.0026 -2.7081 0.3809 H 1 UNK 0.0515 31 H5 -3.2135 -1.7354 -1.0708 H 1 UNK 0.0515 32 H6 -5.8759 -1.1996 2.4856 H 1 UNK 0.0812 33 H7 -7.2221 -1.3796 1.3668 H 1 UNK 0.0812 34 H8 -5.1744 -1.4176 -1.5806 H 1 UNK 0.0812 35 H9 -5.9565 0.0021 -0.8953 H 1 UNK 0.0812 36 H10 -5.4729 1.0450 1.6174 H 1 UNK 0.0281 37 H11 -7.1067 0.8986 2.2192 H 1 UNK 0.0281 38 H12 -6.8021 0.8566 0.4991 H 1 UNK 0.0281 39 H13 -7.1435 -2.7498 -1.0316 H 1 UNK 0.0281 40 H14 -7.5751 -1.4003 -2.0541 H 1 UNK 0.0281 41 H15 -7.9108 -1.3404 -0.3404 H 1 UNK 0.0281 42 H16 1.0384 -1.7857 -0.6133 H 1 UNK 0.0678 43 H17 5.8015 -2.4879 -0.8505 H 1 UNK 0.0298 44 H18 5.5161 -2.7422 0.8709 H 1 UNK 0.0298 45 H19 4.8835 -0.4060 1.1168 H 1 UNK 0.0697 46 H20 5.1584 -0.1394 -0.5834 H 1 UNK 0.0697 47 H21 7.2756 -1.1409 1.3945 H 1 UNK 0.0264 48 H22 7.5776 -0.9366 -0.3294 H 1 UNK 0.0264 49 H23 -1.3482 2.2981 -0.4386 H 1 UNK 0.0624 50 H24 3.2689 3.4174 0.4820 H 1 UNK 0.0639 51 H25 -0.7250 4.6019 -0.0138 H 1 UNK 0.0618 52 H26 1.5903 5.1553 0.4462 H 1 UNK 0.0618 53 H27 7.8995 -3.4915 1.2083 H 1 UNK 0.0230 54 H28 9.1982 -2.4622 0.6542 H 1 UNK 0.0230 55 H29 8.1825 -3.2871 -0.5038 H 1 UNK 0.0230 @BOND 1 1 18 1 2 1 19 1 3 2 14 2 4 3 6 1 5 3 8 1 6 3 9 1 7 4 7 1 8 4 14 am 9 5 15 ar 10 5 18 ar 11 6 7 1 12 8 11 1 13 9 12 1 14 10 13 ar 15 10 14 1 16 10 16 ar 17 13 15 ar 18 13 21 ar 19 15 22 ar 20 16 18 ar 21 17 19 1 22 17 20 1 23 20 25 1 24 21 23 ar 25 22 24 ar 26 23 24 ar 27 3 26 1 28 4 27 1 29 6 28 1 30 6 29 1 31 7 30 1 32 7 31 1 33 8 32 1 34 8 33 1 35 9 34 1 36 9 35 1 37 11 36 1 38 11 37 1 39 11 38 1 40 12 39 1 41 12 40 1 42 12 41 1 43 16 42 1 44 17 43 1 45 17 44 1 46 19 45 1 47 19 46 1 48 20 47 1 49 20 48 1 50 21 49 1 51 22 50 1 52 23 51 1 53 24 52 1 54 25 53 1 55 25 54 1 56 25 55 1