@MOLECULE (1r,2r,4r,8r)-4-methoxy-14-oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one 35 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.8371 -1.1379 0.9952 O.3 1 UNL1111111111 -0.3951 2 O 3.0032 -1.6651 0.0890 O.3 1 UNL1111111111 -0.3860 3 O -3.2087 -2.6929 0.1548 O.2 1 UNL1111111111 -0.4070 4 N 0.7430 1.3938 0.8093 N.3 1 UNL1111111111 -0.4442 5 C 0.3213 -0.0286 0.6252 C.3 1 UNL1111111111 0.0340 6 C -1.2348 0.0565 0.5408 C.3 1 UNL1111111111 0.1817 7 C -0.4859 2.2431 0.7194 C.3 1 UNL1111111111 0.0350 8 C -1.5543 1.3128 1.3688 C.3 1 UNL1111111111 -0.3154 9 C 0.9559 -0.7499 -0.5654 C.3 1 UNL1111111111 -0.3454 10 C 1.8377 1.8176 -0.0828 C.3 1 UNL1111111111 -0.0964 11 C -1.8095 0.3050 -0.8585 C.2 1 UNL1111111111 0.0286 12 C 2.4822 -0.5614 -0.6402 C.3 1 UNL1111111111 0.1251 13 C 2.9458 0.7582 -0.0073 C.3 1 UNL1111111111 -0.3430 14 C -0.9031 2.5277 -0.7120 C.2 1 UNL1111111111 -0.1461 15 C -1.5018 1.5837 -1.4595 C.2 1 UNL1111111111 -0.1851 16 C -2.6157 -0.7191 -1.1770 C.2 1 UNL1111111111 -0.3184 17 C -2.6405 -1.6593 -0.0281 C.2 1 UNL1111111111 0.5860 18 C 4.4000 -1.8350 -0.0473 C.3 1 UNL1111111111 -0.1999 19 H 0.6046 -0.5587 1.5763 H 1 UNL1111111111 0.1808 20 H -0.3092 3.1736 1.3000 H 1 UNL1111111111 0.1546 21 H -1.3774 1.1615 2.4448 H 1 UNL1111111111 0.1774 22 H -2.5832 1.6776 1.2572 H 1 UNL1111111111 0.1606 23 H 0.7305 -1.8381 -0.4895 H 1 UNL1111111111 0.1817 24 H 0.5087 -0.4097 -1.5172 H 1 UNL1111111111 0.1500 25 H 2.2108 2.7971 0.2928 H 1 UNL1111111111 0.1416 26 H 1.5260 1.9646 -1.1398 H 1 UNL1111111111 0.1179 27 H 2.8216 -0.6408 -1.6976 H 1 UNL1111111111 0.1126 28 H 3.8648 1.1285 -0.4926 H 1 UNL1111111111 0.1398 29 H 3.2062 0.5757 1.0598 H 1 UNL1111111111 0.1800 30 H -0.6749 3.5188 -1.0881 H 1 UNL1111111111 0.1508 31 H -1.8009 1.7467 -2.4923 H 1 UNL1111111111 0.1663 32 H -3.2027 -0.8992 -2.0571 H 1 UNL1111111111 0.1923 33 H 4.6849 -1.9602 -1.0967 H 1 UNL1111111111 0.1181 34 H 4.5935 -2.7605 0.5102 H 1 UNL1111111111 0.1474 35 H 4.9432 -1.0020 0.4082 H 1 UNL1111111111 0.1193 @BOND 1 1 6 1 2 1 17 1 3 2 12 1 4 2 18 1 5 3 17 2 6 4 5 1 7 4 7 1 8 4 10 1 9 5 6 1 10 5 9 1 11 5 19 1 12 6 8 1 13 6 11 1 14 7 8 1 15 7 14 1 16 7 20 1 17 8 21 1 18 8 22 1 19 9 12 1 20 9 23 1 21 9 24 1 22 10 13 1 23 10 25 1 24 10 26 1 25 11 15 1 26 11 16 2 27 12 13 1 28 12 27 1 29 13 28 1 30 13 29 1 31 14 15 2 32 14 30 1 33 15 31 1 34 16 17 1 35 16 32 1 36 18 33 1 37 18 34 1 38 18 35 1