@MOLECULE FDBD01819 31 31 0 0 0 SMALL GASTEIGER @ATOM 1 I 0.0315 3.1193 -0.8941 I 1 UNK -0.0399 2 I1 2.8676 -2.2040 0.0526 I 1 UNK -0.0412 3 I2 -3.2336 -1.9854 -0.1475 I 1 UNK -0.0412 4 O 4.1481 1.9961 0.6484 O.2 1 UNK -0.2756 5 O1 -0.2803 -3.4785 1.4523 O.co2 1 UNK -0.5446 6 O2 -0.2299 -4.0368 -0.7505 O.co2 1 UNK -0.5446 7 O3 -3.0004 1.7701 1.5669 O.2 1 UNK -0.2758 8 N 2.3646 0.9349 -0.4734 N.am 1 UNK -0.2728 9 N1 -2.4742 1.1083 -0.6322 N.am 1 UNK -0.2840 10 C 1.1232 0.2866 -0.4007 C.ar 1 UNK 0.0647 11 C1 -1.2899 0.3730 -0.4797 C.ar 1 UNK 0.0624 12 C2 -0.0550 1.0176 -0.5519 C.ar 1 UNK 0.0580 13 C3 1.0666 -1.0892 -0.1773 C.ar 1 UNK 0.0457 14 C4 -0.1682 -1.7338 -0.1051 C.ar 1 UNK 0.0272 15 C5 -1.3465 -1.0027 -0.2563 C.ar 1 UNK 0.0455 16 C6 3.0692 0.9629 -1.7889 C.3 1 UNK 0.0083 17 C7 3.0235 1.4898 0.6729 C.2 1 UNK 0.2165 18 C8 -0.2277 -3.1774 0.1294 C.2 1 UNK 0.0738 19 C9 2.2788 1.4869 1.9882 C.3 1 UNK 0.0127 20 C10 -3.2284 1.7361 0.3619 C.2 1 UNK 0.2141 21 C11 -4.4391 2.4263 -0.2146 C.3 1 UNK 0.0125 22 H -2.8156 1.1923 -1.5518 H 1 UNK 0.1549 23 H1 2.4482 0.5141 -2.5358 H 1 UNK 0.0433 24 H2 3.9870 0.4180 -1.7136 H 1 UNK 0.0433 25 H3 3.2776 1.9767 -2.0604 H 1 UNK 0.0433 26 H4 2.8914 1.9291 2.7459 H 1 UNK 0.0323 27 H5 2.0435 0.4798 2.2626 H 1 UNK 0.0323 28 H6 1.3744 2.0497 1.8872 H 1 UNK 0.0323 29 H7 -4.9914 2.8948 0.5731 H 1 UNK 0.0323 30 H8 -5.0597 1.7065 -0.7061 H 1 UNK 0.0323 31 H9 -4.1252 3.1673 -0.9197 H 1 UNK 0.0323 @BOND 1 1 12 1 2 2 13 1 3 3 15 1 4 4 17 2 5 5 18 ar 6 6 18 ar 7 7 20 2 8 8 10 1 9 8 16 1 10 8 17 am 11 9 11 1 12 9 20 am 13 10 12 ar 14 10 13 ar 15 11 12 ar 16 11 15 ar 17 13 14 ar 18 14 15 ar 19 14 18 1 20 17 19 1 21 20 21 1 22 9 22 1 23 16 23 1 24 16 24 1 25 16 25 1 26 19 26 1 27 19 27 1 28 19 28 1 29 21 29 1 30 21 30 1 31 21 31 1