@MOLECULE tetraphen-7,12-dion 30 33 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.1778 2.2009 -0.8593 O.2 1 UNL1111 -0.4131 2 O -1.7619 -2.7241 -0.4579 O.2 1 UNL1111 -0.4086 3 C 0.5084 0.0393 -0.1663 C.ar 1 UNL1111 -0.1051 4 C 0.0600 -1.2657 -0.1281 C.ar 1 UNL1111 -0.1038 5 C 1.8949 0.3217 -0.0082 C.ar 1 UNL1111 0.0155 6 C -1.8979 0.8306 -0.0655 C.ar 1 UNL1111 -0.1104 7 C -2.3414 -0.4922 0.0057 C.ar 1 UNL1111 -0.1173 8 C -0.4806 1.1258 -0.3991 C.2 1 UNL1111 0.4517 9 C 2.7931 -0.7638 0.1498 C.ar 1 UNL1111 0.0061 10 C -1.3857 -1.5997 -0.2262 C.2 1 UNL1111 0.4478 11 C 0.9617 -2.3434 0.0214 C.ar 1 UNL1111 -0.1165 12 C 2.3038 -2.0963 0.1537 C.ar 1 UNL1111 -0.1394 13 C 2.4272 1.6433 0.0113 C.ar 1 UNL1111 -0.1327 14 C -2.7880 1.8790 0.1472 C.ar 1 UNL1111 -0.0976 15 C -3.6751 -0.7703 0.2888 C.ar 1 UNL1111 -0.0964 16 C 4.1863 -0.5133 0.3016 C.ar 1 UNL1111 -0.1706 17 C 3.7718 1.8596 0.1602 C.ar 1 UNL1111 -0.1532 18 C 4.6660 0.7689 0.3033 C.ar 1 UNL1111 -0.1278 19 C -4.1241 1.6001 0.4437 C.ar 1 UNL1111 -0.1364 20 C -4.5660 0.2816 0.5135 C.ar 1 UNL1111 -0.1377 21 H 0.5676 -3.3638 0.0228 H 1 UNL1111 0.1800 22 H 3.0126 -2.9170 0.2644 H 1 UNL1111 0.1589 23 H 1.7522 2.4965 -0.0987 H 1 UNL1111 0.1850 24 H -2.4394 2.9120 0.0747 H 1 UNL1111 0.1737 25 H -4.0169 -1.8075 0.3300 H 1 UNL1111 0.1739 26 H 4.8596 -1.3613 0.4155 H 1 UNL1111 0.1549 27 H 4.1734 2.8723 0.1703 H 1 UNL1111 0.1561 28 H 5.7303 0.9704 0.4150 H 1 UNL1111 0.1530 29 H -4.8218 2.4187 0.6161 H 1 UNL1111 0.1548 30 H -5.6095 0.0667 0.7404 H 1 UNL1111 0.1553 @BOND 1 1 8 2 2 2 10 2 3 3 4 ar 4 3 5 ar 5 3 8 1 6 4 10 1 7 4 11 ar 8 5 9 ar 9 5 13 ar 10 6 7 ar 11 6 8 1 12 6 14 ar 13 7 10 1 14 7 15 ar 15 9 12 ar 16 9 16 ar 17 11 12 ar 18 11 21 1 19 12 22 1 20 13 17 ar 21 13 23 1 22 14 19 ar 23 14 24 1 24 15 20 ar 25 15 25 1 26 16 18 ar 27 16 26 1 28 17 18 ar 29 17 27 1 30 18 28 1 31 19 20 ar 32 19 29 1 33 20 30 1