@MOLECULE 4-thien-2-ylaniline 21 22 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.1600 1.1737 0.0272 S.2 1 UNL1111111111 0.2010 2 N 4.4624 0.0639 0.0011 N.pl3 1 UNL1111111111 -0.6331 3 C 0.2870 -0.1633 -0.0033 C.ar 1 UNL1111111111 -0.1182 4 C -1.1554 -0.2632 -0.0056 C.ar 1 UNL1111111111 -0.1112 5 C 0.9876 -0.0895 -1.2123 C.ar 1 UNL1111111111 -0.0490 6 C 0.9883 -0.1465 1.2075 C.ar 1 UNL1111111111 -0.0490 7 C 3.0726 0.0274 0.0003 C.ar 1 UNL1111111111 0.2761 8 C 2.3710 0.0084 -1.2214 C.ar 1 UNL1111111111 -0.2999 9 C 2.3715 -0.0500 1.2199 C.ar 1 UNL1111111111 -0.3000 10 C -1.9321 -1.3848 -0.0317 C.ar 1 UNL1111111111 -0.1865 11 C -3.3400 -1.0998 -0.0257 C.ar 1 UNL1111111111 -0.1622 12 C -3.6230 0.2329 0.0049 C.ar 1 UNL1111111111 -0.2822 13 H 0.4381 -0.1099 -2.1545 H 1 UNL1111111111 0.1546 14 H 0.4400 -0.2138 2.1483 H 1 UNL1111111111 0.1546 15 H 2.9092 0.0610 -2.1617 H 1 UNL1111111111 0.1592 16 H 2.9103 -0.0416 2.1612 H 1 UNL1111111111 0.1592 17 H -1.5507 -2.3948 -0.0549 H 1 UNL1111111111 0.1672 18 H -4.0762 -1.8888 -0.0441 H 1 UNL1111111111 0.1597 19 H -4.5928 0.6944 0.0150 H 1 UNL1111111111 0.1720 20 H 4.9443 0.2646 0.8501 H 1 UNL1111111111 0.2938 21 H 4.9439 0.3071 -0.8370 H 1 UNL1111111111 0.2938 @BOND 1 1 4 ar 2 1 12 ar 3 2 7 1 4 2 20 1 5 2 21 1 6 3 4 1 7 3 5 ar 8 3 6 ar 9 4 10 ar 10 5 8 ar 11 5 13 1 12 6 9 ar 13 6 14 1 14 7 8 ar 15 7 9 ar 16 8 15 1 17 9 16 1 18 10 11 ar 19 10 17 1 20 11 12 ar 21 11 18 1 22 12 19 1