@MOLECULE 3-ethynylperylene 34 38 0 0 0 SMALL GASTEIGER @ATOM 1 C -0.9210 0.2186 -0.0002 C.ar 1 UNL1111111111 -0.0159 2 C 1.9244 -0.1099 0.0004 C.ar 1 UNL1111111111 -0.0123 3 C -0.3663 -1.0980 -0.0006 C.ar 1 UNL1111111111 0.0070 4 C -0.0796 1.3750 0.0015 C.ar 1 UNL1111111111 -0.0049 5 C 1.0875 -1.2677 -0.0003 C.ar 1 UNL1111111111 -0.0103 6 C 1.3743 1.2081 0.0014 C.ar 1 UNL1111111111 -0.0088 7 C -2.3264 0.3837 -0.0006 C.ar 1 UNL1111111111 0.0129 8 C 3.3280 -0.2715 0.0002 C.ar 1 UNL1111111111 0.0002 9 C -1.2167 -2.1862 -0.0010 C.ar 1 UNL1111111111 -0.1596 10 C -0.6536 2.6301 0.0028 C.ar 1 UNL1111111111 -0.1479 11 C 1.6690 -2.5203 -0.0005 C.ar 1 UNL1111111111 -0.1466 12 C 2.2260 2.2948 0.0005 C.ar 1 UNL1111111111 -0.1514 13 C -3.1782 -0.7673 -0.0006 C.ar 1 UNL1111111111 0.0053 14 C -2.8766 1.6937 -0.0011 C.ar 1 UNL1111111111 -0.1506 15 C 3.8893 -1.5778 0.0024 C.ar 1 UNL1111111111 -0.1521 16 C 4.1728 0.8715 -0.0032 C.ar 1 UNL1111111111 -0.1549 17 C -2.6164 -2.0274 -0.0005 C.ar 1 UNL1111111111 -0.1253 18 C -2.0556 2.7912 0.0008 C.ar 1 UNL1111111111 -0.1379 19 C 3.0722 -2.6783 0.0018 C.ar 1 UNL1111111111 -0.1444 20 C 3.6286 2.1293 -0.0027 C.ar 1 UNL1111111111 -0.1399 21 C -4.5838 -0.6313 -0.0004 C.1 1 UNL1111111111 -0.0728 22 C -5.7926 -0.5305 0.0002 C.1 1 UNL1111111111 -0.1887 23 H -0.8224 -3.2039 -0.0010 H 1 UNL1111111111 0.1599 24 H -0.0372 3.5296 0.0050 H 1 UNL1111111111 0.1555 25 H 1.0561 -3.4221 -0.0021 H 1 UNL1111111111 0.1564 26 H 1.8355 3.3117 0.0012 H 1 UNL1111111111 0.1559 27 H -3.9607 1.8062 -0.0028 H 1 UNL1111111111 0.1612 28 H 4.9722 -1.6841 0.0043 H 1 UNL1111111111 0.1528 29 H 5.2512 0.7265 -0.0056 H 1 UNL1111111111 0.1528 30 H -3.2467 -2.9171 0.0003 H 1 UNL1111111111 0.1602 31 H -2.4696 3.7986 0.0001 H 1 UNL1111111111 0.1530 32 H 3.4892 -3.6844 0.0037 H 1 UNL1111111111 0.1524 33 H 4.2634 3.0143 -0.0058 H 1 UNL1111111111 0.1522 34 H -6.8175 -0.4409 0.0008 H 1 UNL1111111111 0.1869 @BOND 1 1 3 ar 2 1 4 ar 3 1 7 ar 4 2 5 ar 5 2 6 ar 6 2 8 ar 7 3 5 ar 8 3 9 ar 9 4 6 ar 10 4 10 ar 11 5 11 ar 12 6 12 ar 13 7 13 ar 14 7 14 ar 15 8 15 ar 16 8 16 ar 17 9 17 ar 18 9 23 1 19 10 18 ar 20 10 24 1 21 11 19 ar 22 11 25 1 23 12 20 ar 24 12 26 1 25 13 17 ar 26 13 21 1 27 14 18 ar 28 14 27 1 29 15 19 ar 30 15 28 1 31 16 20 ar 32 16 29 1 33 17 30 1 34 18 31 1 35 19 32 1 36 20 33 1 37 21 22 3 38 22 34 1