@MOLECULE isosakuranetin 35 37 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2992 -0.6262 0.2704 O.3 1 UNL1111111111 -0.3281 2 O 2.1941 2.9165 -0.4815 O.2 1 UNL1111111111 -0.4382 3 O 4.4426 1.6292 -0.2926 O.3 1 UNL1111111111 -0.3959 4 O -5.8467 -0.3128 0.0363 O.3 1 UNL1111111111 -0.3148 5 O 4.1823 -3.1281 0.1713 O.3 1 UNL1111111111 -0.4552 6 C -0.3388 0.6302 0.5923 C.3 1 UNL1111111111 0.1367 7 C 0.1479 1.7444 -0.3224 C.3 1 UNL1111111111 -0.4419 8 C -1.7992 0.3492 0.4064 C.ar 1 UNL1111111111 -0.1331 9 C 2.3627 0.5913 -0.0780 C.ar 1 UNL1111111111 -0.4589 10 C 1.6615 1.8519 -0.2920 C.2 1 UNL1111111111 0.5188 11 C 1.6370 -0.5977 0.1372 C.ar 1 UNL1111111111 0.4080 12 C 3.7637 0.4813 -0.1384 C.ar 1 UNL1111111111 0.4553 13 C -2.7237 0.9000 1.3011 C.ar 1 UNL1111111111 -0.0813 14 C -2.2319 -0.4515 -0.6484 C.ar 1 UNL1111111111 -0.0502 15 C 2.2464 -1.8517 0.2054 C.ar 1 UNL1111111111 -0.4399 16 C 4.4254 -0.7491 -0.0516 C.ar 1 UNL1111111111 -0.5611 17 C 3.6374 -1.8953 0.1017 C.ar 1 UNL1111111111 0.4438 18 C -4.0782 0.6590 1.1393 C.ar 1 UNL1111111111 -0.2542 19 C -3.5892 -0.7137 -0.8245 C.ar 1 UNL1111111111 -0.3073 20 C -4.4987 -0.1541 0.0724 C.ar 1 UNL1111111111 0.2611 21 C -6.3807 -1.1266 -0.9989 C.3 1 UNL1111111111 -0.2030 22 H -0.0764 0.8325 1.6584 H 1 UNL1111111111 0.1450 23 H -0.3118 2.7135 -0.0376 H 1 UNL1111111111 0.1888 24 H -0.1736 1.5747 -1.3712 H 1 UNL1111111111 0.1875 25 H -2.3812 1.5217 2.1289 H 1 UNL1111111111 0.1555 26 H -1.5041 -0.8842 -1.3391 H 1 UNL1111111111 0.1651 27 H 1.6636 -2.7562 0.3462 H 1 UNL1111111111 0.2039 28 H 5.5015 -0.8098 -0.1043 H 1 UNL1111111111 0.1754 29 H -4.8154 1.0800 1.8178 H 1 UNL1111111111 0.1735 30 H -3.9156 -1.3430 -1.6445 H 1 UNL1111111111 0.1646 31 H 5.4261 1.4857 -0.3333 H 1 UNL1111111111 0.3209 32 H 5.1702 -3.1133 0.1031 H 1 UNL1111111111 0.3324 33 H -6.1653 -0.6987 -1.9837 H 1 UNL1111111111 0.1356 34 H -7.4593 -1.0847 -0.7921 H 1 UNL1111111111 0.1548 35 H -6.0154 -2.1549 -0.9161 H 1 UNL1111111111 0.1365 @BOND 1 1 6 1 2 1 11 1 3 2 10 2 4 3 12 1 5 3 31 1 6 4 20 1 7 4 21 1 8 5 17 1 9 5 32 1 10 6 7 1 11 6 8 1 12 6 22 1 13 7 10 1 14 7 23 1 15 7 24 1 16 8 13 ar 17 8 14 ar 18 9 10 1 19 9 11 ar 20 9 12 ar 21 11 15 ar 22 12 16 ar 23 13 18 ar 24 13 25 1 25 14 19 ar 26 14 26 1 27 15 17 ar 28 15 27 1 29 16 17 ar 30 16 28 1 31 18 20 ar 32 18 29 1 33 19 20 ar 34 19 30 1 35 21 33 1 36 21 34 1 37 21 35 1