@MOLECULE FDBD00304 44 46 0 0 0 SMALL GASTEIGER @ATOM 1 N -2.6672 1.5652 0.5685 N.4 1 UNK 0.2381 2 N1 2.0212 2.2611 -0.2203 N.ar 1 UNK -0.2550 3 C -4.0433 1.1982 0.9016 C.3 1 UNK -0.0314 4 C1 -2.5669 1.3875 -0.8799 C.3 1 UNK -0.0314 5 C2 -4.8481 1.8471 -0.2147 C.3 1 UNK -0.0077 6 C3 -3.8789 1.9683 -1.3866 C.3 1 UNK -0.0077 7 C4 -1.6887 0.7695 1.2950 C.3 1 UNK -0.0121 8 C5 -0.2845 1.1693 0.9320 C.2 1 UNK -0.0297 9 C6 0.6975 0.3911 0.4247 C.2 1 UNK 0.0085 10 C7 0.3850 -1.0419 0.1835 C.ar 1 UNK -0.0160 11 C8 2.0280 0.9654 0.1241 C.ar 1 UNK 0.0714 12 C9 0.6138 -1.9522 1.1940 C.ar 1 UNK -0.0537 13 C10 -0.1236 -1.4149 -1.0431 C.ar 1 UNK -0.0537 14 C11 3.1366 0.1605 0.2135 C.ar 1 UNK -0.0357 15 C12 -0.1948 -3.7007 -0.2641 C.ar 1 UNK -0.0504 16 C13 0.3206 -3.2969 0.9676 C.ar 1 UNK -0.0583 17 C14 -0.4168 -2.7596 -1.2694 C.ar 1 UNK -0.0583 18 C15 4.3644 0.7436 -0.0797 C.ar 1 UNK -0.0583 19 C16 -0.5090 -5.1385 -0.5055 C.3 1 UNK -0.0397 20 C17 3.2326 2.7932 -0.4981 C.ar 1 UNK 0.0283 21 C18 4.4219 2.0846 -0.4430 C.ar 1 UNK -0.0436 22 H -2.4584 2.5250 0.8435 H 1 UNK 0.2037 23 H1 -4.3254 1.5891 1.8569 H 1 UNK 0.0814 24 H2 -4.1935 0.1411 0.9712 H 1 UNK 0.0814 25 H3 -2.4804 0.3521 -1.1354 H 1 UNK 0.0814 26 H4 -1.7050 1.8586 -1.3042 H 1 UNK 0.0814 27 H5 -5.1961 2.8132 0.0861 H 1 UNK 0.0319 28 H6 -5.7145 1.2731 -0.4694 H 1 UNK 0.0319 29 H7 -4.2357 1.4117 -2.2279 H 1 UNK 0.0319 30 H8 -3.7689 2.9817 -1.7118 H 1 UNK 0.0319 31 H9 -1.8308 -0.2633 1.0543 H 1 UNK 0.0861 32 H10 -1.8280 0.9354 2.3429 H 1 UNK 0.0861 33 H11 -0.0410 2.1597 1.0897 H 1 UNK 0.0632 34 H12 0.9953 -1.6438 2.1019 H 1 UNK 0.0624 35 H13 -0.2844 -0.7112 -1.7807 H 1 UNK 0.0624 36 H14 3.0621 -0.8321 0.4859 H 1 UNK 0.0639 37 H15 0.4850 -3.9932 1.7114 H 1 UNK 0.0620 38 H16 -0.7980 -3.0583 -2.1807 H 1 UNK 0.0620 39 H17 5.2295 0.1834 -0.0279 H 1 UNK 0.0619 40 H18 -0.2759 -5.7065 0.3708 H 1 UNK 0.0278 41 H19 0.0730 -5.4975 -1.3285 H 1 UNK 0.0278 42 H20 -1.5495 -5.2431 -0.7320 H 1 UNK 0.0278 43 H21 3.2740 3.7885 -0.7678 H 1 UNK 0.0830 44 H22 5.3222 2.5378 -0.6646 H 1 UNK 0.0633 @BOND 1 1 3 1 2 1 4 1 3 1 7 1 4 2 11 ar 5 2 20 ar 6 3 5 1 7 4 6 1 8 5 6 1 9 7 8 1 10 8 9 2 11 9 10 1 12 9 11 1 13 10 12 ar 14 10 13 ar 15 11 14 ar 16 12 16 ar 17 13 17 ar 18 14 18 ar 19 15 16 ar 20 15 17 ar 21 15 19 1 22 18 21 ar 23 20 21 ar 24 1 22 1 25 3 23 1 26 3 24 1 27 4 25 1 28 4 26 1 29 5 27 1 30 5 28 1 31 6 29 1 32 6 30 1 33 7 31 1 34 7 32 1 35 8 33 1 36 12 34 1 37 13 35 1 38 14 36 1 39 16 37 1 40 17 38 1 41 18 39 1 42 19 40 1 43 19 41 1 44 19 42 1 45 20 43 1 46 21 44 1