@MOLECULE FDBD00156 44 45 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.5619 2.7899 -1.4850 O.2 1 UNK -0.2751 2 N 2.6471 -0.1268 0.2962 N.4 1 UNK 0.2354 3 N1 -3.9976 0.6057 -0.7320 N.am 1 UNK -0.2850 4 C 1.2922 -0.5733 -0.0092 C.3 1 UNK -0.0278 5 C1 0.3149 -0.2398 1.1285 C.3 1 UNK 0.0130 6 C2 -1.0661 -0.7145 0.8410 C.ar 1 UNK -0.0370 7 C3 2.6776 1.3221 0.5008 C.3 1 UNK -0.0321 8 C4 3.5684 -0.5084 -0.7753 C.3 1 UNK -0.0321 9 C5 -1.9838 0.0853 0.1884 C.ar 1 UNK -0.0141 10 C6 -1.8383 1.4775 -0.3384 C.3 1 UNK 0.0514 11 C7 -3.2714 -0.3778 -0.0699 C.ar 1 UNK 0.0373 12 C8 4.0978 1.7824 0.8199 C.3 1 UNK -0.0153 13 C9 3.5854 -2.0255 -0.9443 C.3 1 UNK -0.0153 14 C10 -1.4723 -1.9950 1.2301 C.ar 1 UNK -0.0580 15 C11 -3.2225 1.7526 -0.9367 C.2 1 UNK 0.2216 16 C12 -3.6979 -1.6362 0.3030 C.ar 1 UNK -0.0402 17 C13 -2.7768 -2.4517 0.9632 C.ar 1 UNK -0.0597 18 C14 4.1530 3.2835 1.0584 C.3 1 UNK -0.0605 19 C15 4.5523 -2.4501 -2.0387 C.3 1 UNK -0.0605 20 H 2.9466 -0.5820 1.1584 H 1 UNK 0.2033 21 H1 -4.9342 0.5080 -1.0191 H 1 UNK 0.1548 22 H2 1.3016 -1.6327 -0.1591 H 1 UNK 0.0818 23 H3 0.9638 -0.0645 -0.8914 H 1 UNK 0.0818 24 H4 0.2932 0.8214 1.2641 H 1 UNK 0.0365 25 H5 0.6564 -0.7385 2.0115 H 1 UNK 0.0365 26 H6 2.0325 1.5772 1.3154 H 1 UNK 0.0814 27 H7 2.3474 1.8070 -0.3940 H 1 UNK 0.0814 28 H8 4.5535 -0.1694 -0.5312 H 1 UNK 0.0814 29 H9 3.2426 -0.0599 -1.6905 H 1 UNK 0.0814 30 H10 -1.0760 1.5297 -1.0875 H 1 UNK 0.0408 31 H11 -1.5474 2.1874 0.4075 H 1 UNK 0.0408 32 H12 4.7367 1.5366 -0.0025 H 1 UNK 0.0314 33 H13 4.4204 1.2871 1.7118 H 1 UNK 0.0314 34 H14 2.6013 -2.3585 -1.2005 H 1 UNK 0.0314 35 H15 3.9060 -2.4639 -0.0224 H 1 UNK 0.0314 36 H16 -0.8067 -2.6134 1.7195 H 1 UNK 0.0620 37 H17 -4.6568 -1.9606 0.1024 H 1 UNK 0.0636 38 H18 -3.0556 -3.4003 1.2590 H 1 UNK 0.0618 39 H19 3.8333 3.7969 0.1757 H 1 UNK 0.0232 40 H20 5.1564 3.5705 1.2942 H 1 UNK 0.0232 41 H21 3.5081 3.5392 1.8730 H 1 UNK 0.0232 42 H22 4.2476 -2.0207 -2.9702 H 1 UNK 0.0232 43 H23 4.5520 -3.5170 -2.1207 H 1 UNK 0.0232 44 H24 5.5376 -2.1114 -1.7952 H 1 UNK 0.0232 @BOND 1 1 15 2 2 2 4 1 3 2 7 1 4 2 8 1 5 3 11 1 6 3 15 am 7 4 5 1 8 5 6 1 9 6 9 ar 10 6 14 ar 11 7 12 1 12 8 13 1 13 9 10 1 14 9 11 ar 15 10 15 1 16 11 16 ar 17 12 18 1 18 13 19 1 19 14 17 ar 20 16 17 ar 21 2 20 1 22 3 21 1 23 4 22 1 24 4 23 1 25 5 24 1 26 5 25 1 27 7 26 1 28 7 27 1 29 8 28 1 30 8 29 1 31 10 30 1 32 10 31 1 33 12 32 1 34 12 33 1 35 13 34 1 36 13 35 1 37 14 36 1 38 16 37 1 39 17 38 1 40 18 39 1 41 18 40 1 42 18 41 1 43 19 42 1 44 19 43 1 45 19 44 1