@MOLECULE 1,8-diphenyl-15,16-dioxatetracyclo[6.6.2.0~2,7~.0~9,14~]hexadeca-2,4,6,9,11,13-hexaene 46 51 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.7177 0.0011 1.5961 O.3 1 UNL1111111111 -0.1386 2 O 0.7171 -0.0007 1.5970 O.3 1 UNL1111111111 -0.1385 3 C -1.2754 0.0003 0.2667 C.3 1 UNL1111111111 0.1434 4 C 1.2750 0.0000 0.2684 C.3 1 UNL1111111111 0.1435 5 C -0.7030 -1.2253 -0.4134 C.ar 1 UNL1111111111 -0.0442 6 C -0.7033 1.2260 -0.4137 C.ar 1 UNL1111111111 -0.0441 7 C 0.7028 -1.2254 -0.4127 C.ar 1 UNL1111111111 -0.0443 8 C 0.7026 1.2255 -0.4121 C.ar 1 UNL1111111111 -0.0443 9 C -2.7625 0.0001 0.4486 C.ar 1 UNL1111111111 -0.0318 10 C 2.7621 -0.0000 0.4505 C.ar 1 UNL1111111111 -0.0319 11 C -1.4062 -2.2874 -0.9561 C.ar 1 UNL1111111111 -0.1396 12 C -1.4063 2.2875 -0.9576 C.ar 1 UNL1111111111 -0.1397 13 C 1.4066 -2.2876 -0.9544 C.ar 1 UNL1111111111 -0.1396 14 C 1.4063 2.2882 -0.9535 C.ar 1 UNL1111111111 -0.1396 15 C -0.6955 -3.3507 -1.5205 C.ar 1 UNL1111111111 -0.1396 16 C -0.6955 3.3515 -1.5199 C.ar 1 UNL1111111111 -0.1395 17 C 0.6967 -3.3510 -1.5193 C.ar 1 UNL1111111111 -0.1396 18 C 0.6967 3.3517 -1.5182 C.ar 1 UNL1111111111 -0.1396 19 C -3.5893 -0.0005 -0.6784 C.ar 1 UNL1111111111 -0.1600 20 C 3.5873 0.0006 -0.6778 C.ar 1 UNL1111111111 -0.1600 21 C -3.3223 0.0006 1.7260 C.ar 1 UNL1111111111 -0.1271 22 C 3.3237 -0.0004 1.7270 C.ar 1 UNL1111111111 -0.1270 23 C -4.9725 -0.0013 -0.5261 C.ar 1 UNL1111111111 -0.1415 24 C 4.9707 0.0002 -0.5276 C.ar 1 UNL1111111111 -0.1415 25 C -4.7090 0.0001 1.8729 C.ar 1 UNL1111111111 -0.1419 26 C 4.7107 -0.0011 1.8714 C.ar 1 UNL1111111111 -0.1419 27 C -5.5337 -0.0009 0.7505 C.ar 1 UNL1111111111 -0.1481 28 C 5.5339 -0.0009 0.7480 C.ar 1 UNL1111111111 -0.1480 29 H -2.4948 -2.3058 -0.9391 H 1 UNL1111111111 0.1618 30 H -2.4949 2.3052 -0.9421 H 1 UNL1111111111 0.1618 31 H 2.4952 -2.3055 -0.9363 H 1 UNL1111111111 0.1618 32 H 2.4949 2.3066 -0.9343 H 1 UNL1111111111 0.1617 33 H -1.2386 -4.1866 -1.9567 H 1 UNL1111111111 0.1484 34 H -1.2385 4.1879 -1.9559 H 1 UNL1111111111 0.1484 35 H 1.2404 -4.1870 -1.9546 H 1 UNL1111111111 0.1484 36 H 1.2408 4.1881 -1.9526 H 1 UNL1111111111 0.1484 37 H -3.1501 -0.0007 -1.6761 H 1 UNL1111111111 0.1599 38 H 3.1463 0.0013 -1.6747 H 1 UNL1111111111 0.1599 39 H -2.6885 0.0011 2.6147 H 1 UNL1111111111 0.1702 40 H 2.6907 -0.0006 2.6161 H 1 UNL1111111111 0.1701 41 H -5.6155 -0.0025 -1.4035 H 1 UNL1111111111 0.1475 42 H 5.6115 0.0006 -1.4058 H 1 UNL1111111111 0.1474 43 H -5.1462 0.0002 2.8695 H 1 UNL1111111111 0.1495 44 H 5.1492 -0.0020 2.8675 H 1 UNL1111111111 0.1495 45 H -6.6147 -0.0020 0.8691 H 1 UNL1111111111 0.1450 46 H 6.6150 -0.0019 0.8650 H 1 UNL1111111111 0.1450 @BOND 1 1 2 1 2 1 3 1 3 2 4 1 4 3 5 1 5 3 6 1 6 3 9 1 7 4 7 1 8 4 8 1 9 4 10 1 10 5 7 ar 11 5 11 ar 12 6 8 ar 13 6 12 ar 14 7 13 ar 15 8 14 ar 16 9 19 ar 17 9 21 ar 18 10 20 ar 19 10 22 ar 20 11 15 ar 21 11 29 1 22 12 16 ar 23 12 30 1 24 13 17 ar 25 13 31 1 26 14 18 ar 27 14 32 1 28 15 17 ar 29 15 33 1 30 16 18 ar 31 16 34 1 32 17 35 1 33 18 36 1 34 19 23 ar 35 19 37 1 36 20 24 ar 37 20 38 1 38 21 25 ar 39 21 39 1 40 22 26 ar 41 22 40 1 42 23 27 ar 43 23 41 1 44 24 28 ar 45 24 42 1 46 25 27 ar 47 25 43 1 48 26 28 ar 49 26 44 1 50 27 45 1 51 28 46 1