@MOLECULE 2-(1,3-benzodioxol-5-yl)-2-ethylbutanamide 34 35 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.1744 1.2046 0.8746 O.3 1 UNL1111111111 -0.3418 2 O 3.9245 -0.7001 -0.2971 O.3 1 UNL1111111111 -0.3392 3 O -3.3493 -1.5100 -0.2525 O.2 1 UNL1111111111 -0.5421 4 N -1.8868 -1.7889 1.4227 N.am 1 UNL1111111111 -0.6918 5 C -1.6310 0.1972 -0.0684 C.3 1 UNL1111111111 -0.0312 6 C -2.0261 1.2696 0.9706 C.3 1 UNL1111111111 -0.2547 7 C -2.1051 0.5820 -1.4897 C.3 1 UNL1111111111 -0.2437 8 C -0.1406 -0.0652 -0.1125 C.ar 1 UNL1111111111 -0.0172 9 C -2.3676 -1.0954 0.3285 C.2 1 UNL1111111111 0.5791 10 C 0.7723 0.8176 0.4994 C.ar 1 UNL1111111111 -0.2147 11 C -3.5371 1.4556 1.1007 C.3 1 UNL1111111111 -0.4413 12 C -1.4483 1.8556 -2.0133 C.3 1 UNL1111111111 -0.4374 13 C 0.3127 -1.1908 -0.8045 C.ar 1 UNL1111111111 -0.1732 14 C 2.1040 0.5035 0.3777 C.ar 1 UNL1111111111 0.1346 15 C 2.5533 -0.6382 -0.3229 C.ar 1 UNL1111111111 0.1178 16 C 1.6767 -1.5066 -0.9260 C.ar 1 UNL1111111111 -0.1730 17 C 4.3421 0.4612 0.4553 C.3 1 UNL1111111111 0.1580 18 H -1.6027 1.0030 1.9592 H 1 UNL1111111111 0.1388 19 H -1.5666 2.2388 0.6887 H 1 UNL1111111111 0.1490 20 H -3.2097 0.6891 -1.4906 H 1 UNL1111111111 0.1594 21 H -1.9046 -0.2596 -2.1835 H 1 UNL1111111111 0.1491 22 H 0.4561 1.7095 1.0309 H 1 UNL1111111111 0.1788 23 H -3.7783 2.1701 1.8952 H 1 UNL1111111111 0.1419 24 H -3.9811 1.8339 0.1720 H 1 UNL1111111111 0.1513 25 H -4.0510 0.5150 1.3386 H 1 UNL1111111111 0.1578 26 H -1.7491 2.7366 -1.4363 H 1 UNL1111111111 0.1421 27 H -1.7278 2.0380 -3.0575 H 1 UNL1111111111 0.1432 28 H -0.3539 1.7909 -1.9747 H 1 UNL1111111111 0.1498 29 H -0.4113 -1.8583 -1.2783 H 1 UNL1111111111 0.1719 30 H 2.0097 -2.3850 -1.4700 H 1 UNL1111111111 0.1766 31 H -2.3383 -2.6302 1.7186 H 1 UNL1111111111 0.3108 32 H -1.0624 -1.5175 1.9100 H 1 UNL1111111111 0.3073 33 H 4.8569 0.1085 1.3594 H 1 UNL1111111111 0.1414 34 H 4.9254 1.1052 -0.2174 H 1 UNL1111111111 0.1427 @BOND 1 1 14 1 2 1 17 1 3 2 15 1 4 2 17 1 5 3 9 2 6 4 9 am 7 4 31 1 8 4 32 1 9 5 6 1 10 5 7 1 11 5 8 1 12 5 9 1 13 6 11 1 14 6 18 1 15 6 19 1 16 7 12 1 17 7 20 1 18 7 21 1 19 8 10 ar 20 8 13 ar 21 10 14 ar 22 10 22 1 23 11 23 1 24 11 24 1 25 11 25 1 26 12 26 1 27 12 27 1 28 12 28 1 29 13 16 ar 30 13 29 1 31 14 15 ar 32 15 16 ar 33 16 30 1 34 17 33 1 35 17 34 1