@MOLECULE FDBD00299 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2042 -2.1333 0.9271 O.3 1 UNK -0.4674 2 O1 -0.1037 -2.7833 -1.2609 O.2 1 UNK -0.2499 3 N -1.3120 1.6427 -0.3159 N.4 1 UNK 0.2300 4 C -1.2425 0.2183 0.0339 C.3 1 UNK -0.0053 5 C1 -2.5386 -0.5031 -0.3606 C.3 1 UNK -0.0084 6 C2 -0.0430 -0.4113 -0.6720 C.3 1 UNK 0.1238 7 C3 -3.7572 0.1638 0.2717 C.3 1 UNK -0.0431 8 C4 -3.7666 1.6585 -0.0300 C.3 1 UNK -0.0124 9 C5 -2.4360 2.3066 0.3450 C.3 1 UNK -0.0334 10 C6 1.2688 0.2663 -0.3052 C.ar 1 UNK -0.0284 11 C7 0.0026 -1.9122 -0.4071 C.2 1 UNK 0.3198 12 C8 1.4350 0.7493 0.9768 C.ar 1 UNK -0.0576 13 C9 2.2536 0.3781 -1.2657 C.ar 1 UNK -0.0576 14 C10 2.6376 1.3708 1.3130 C.ar 1 UNK -0.0615 15 C11 3.4563 0.9995 -0.9295 C.ar 1 UNK -0.0615 16 C12 3.6483 1.4958 0.3598 C.ar 1 UNK -0.0617 17 C13 0.2932 -3.5068 1.3197 C.3 1 UNK 0.0817 18 H -1.4236 1.7302 -1.3260 H 1 UNK 0.2016 19 H1 -0.4499 2.0897 -0.0040 H 1 UNK 0.2016 20 H2 -1.1247 0.1211 1.0929 H 1 UNK 0.0862 21 H3 -2.4865 -1.5195 -0.0302 H 1 UNK 0.0320 22 H4 -2.6414 -0.4565 -1.4246 H 1 UNK 0.0320 23 H5 -0.1712 -0.2593 -1.7234 H 1 UNK 0.0519 24 H6 -3.7273 0.0189 1.3314 H 1 UNK 0.0269 25 H7 -4.6427 -0.2766 -0.1367 H 1 UNK 0.0269 26 H8 -4.5510 2.1226 0.5306 H 1 UNK 0.0317 27 H9 -3.9236 1.7909 -1.0801 H 1 UNK 0.0317 28 H10 -2.4547 3.3350 0.0502 H 1 UNK 0.0814 29 H11 -2.3046 2.2164 1.4031 H 1 UNK 0.0814 30 H12 0.6817 0.6522 1.6755 H 1 UNK 0.0621 31 H13 2.1026 0.0080 -2.2171 H 1 UNK 0.0621 32 H14 2.7796 1.7381 2.2669 H 1 UNK 0.0618 33 H15 4.2041 1.0920 -1.6347 H 1 UNK 0.0618 34 H16 4.5381 1.9555 0.6085 H 1 UNK 0.0618 35 H17 0.4503 -3.5662 2.3764 H 1 UNK 0.0661 36 H18 1.1120 -3.9709 0.8108 H 1 UNK 0.0661 37 H19 -0.6162 -4.0101 1.0654 H 1 UNK 0.0661 @BOND 1 1 11 1 2 1 17 1 3 2 11 2 4 3 4 1 5 3 9 1 6 4 5 1 7 4 6 1 8 5 7 1 9 6 10 1 10 6 11 1 11 7 8 1 12 8 9 1 13 10 12 ar 14 10 13 ar 15 12 14 ar 16 13 15 ar 17 14 16 ar 18 15 16 ar 19 3 18 1 20 3 19 1 21 4 20 1 22 5 21 1 23 5 22 1 24 6 23 1 25 7 24 1 26 7 25 1 27 8 26 1 28 8 27 1 29 9 28 1 30 9 29 1 31 12 30 1 32 13 31 1 33 14 32 1 34 15 33 1 35 16 34 1 36 17 35 1 37 17 36 1 38 17 37 1