@MOLECULE terbutryn 35 35 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.7603 0.0784 0.0069 S.3 1 UNL1111 0.1712 2 N 0.9090 1.9180 0.0206 N.pl3 1 UNL1111 -0.5249 3 N 0.7160 -0.4564 0.0015 N.ar 1 UNL1111 -0.6718 4 N -1.2221 1.0059 0.0071 N.ar 1 UNL1111 -0.6596 5 N 0.3134 -2.7755 -0.0081 N.pl3 1 UNL1111 -0.4867 6 N -1.5434 -1.3681 -0.0027 N.ar 1 UNL1111 -0.6182 7 C 2.3935 1.9456 -0.0008 C.3 1 UNL1111 0.3474 8 C 2.7997 3.4349 0.0261 C.3 1 UNL1111 -0.4930 9 C 2.9527 1.2332 1.2391 C.3 1 UNL1111 -0.4883 10 C 2.9127 1.2899 -1.2888 C.3 1 UNL1111 -0.4900 11 C 0.1487 0.7909 0.0078 C.ar 1 UNL1111 0.5901 12 C -0.1679 -1.5060 -0.0023 C.ar 1 UNL1111 0.5661 13 C 1.7617 -3.0302 0.0077 C.3 1 UNL1111 -0.0276 14 C -1.9953 -0.0985 0.0022 C.ar 1 UNL1111 0.3528 15 C 2.0165 -4.5360 -0.0050 C.3 1 UNL1111 -0.4652 16 C -3.9887 1.8796 -0.0159 C.3 1 UNL1111 -0.4977 17 H 2.4411 3.9376 0.9311 H 1 UNL1111 0.1550 18 H 3.8909 3.5318 0.0122 H 1 UNL1111 0.1587 19 H 2.4153 3.9786 -0.8438 H 1 UNL1111 0.1542 20 H 2.6976 0.1620 1.2274 H 1 UNL1111 0.1813 21 H 2.5411 1.6490 2.1645 H 1 UNL1111 0.1546 22 H 4.0421 1.3101 1.2823 H 1 UNL1111 0.1495 23 H 2.6340 0.2255 -1.3286 H 1 UNL1111 0.1807 24 H 2.4937 1.7639 -2.1820 H 1 UNL1111 0.1539 25 H 4.0027 1.3453 -1.3490 H 1 UNL1111 0.1503 26 H 0.4185 2.8078 0.0164 H 1 UNL1111 0.3315 27 H -0.3321 -3.5528 -0.0058 H 1 UNL1111 0.3360 28 H 2.2328 -2.5323 -0.8740 H 1 UNL1111 0.1524 29 H 2.2116 -2.5523 0.9112 H 1 UNL1111 0.1511 30 H 1.5762 -5.0330 0.8684 H 1 UNL1111 0.1546 31 H 1.6073 -5.0125 -0.9046 H 1 UNL1111 0.1550 32 H 3.0931 -4.7450 0.0115 H 1 UNL1111 0.1559 33 H -3.6754 2.3178 -0.9713 H 1 UNL1111 0.1735 34 H -3.4051 2.3783 0.7702 H 1 UNL1111 0.1815 35 H -5.0501 2.0957 0.1443 H 1 UNL1111 0.1656 @BOND 1 1 14 1 2 1 16 1 3 2 7 1 4 2 11 1 5 2 26 1 6 3 11 ar 7 3 12 ar 8 4 11 ar 9 4 14 ar 10 5 12 1 11 5 13 1 12 5 27 1 13 6 12 ar 14 6 14 ar 15 7 8 1 16 7 9 1 17 7 10 1 18 8 17 1 19 8 18 1 20 8 19 1 21 9 20 1 22 9 21 1 23 9 22 1 24 10 23 1 25 10 24 1 26 10 25 1 27 13 15 1 28 13 28 1 29 13 29 1 30 15 30 1 31 15 31 1 32 15 32 1 33 16 33 1 34 16 34 1 35 16 35 1