@MOLECULE depudecin 31 32 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.8496 -1.7657 0.0133 O.3 1 UNL1111111111 -0.3421 2 O 2.4220 0.8838 1.7170 O.3 1 UNL1111111111 -0.3460 3 O -4.5877 0.5737 -1.6242 O.3 1 UNL1111111111 -0.5586 4 O 3.9426 1.6017 -1.2512 O.3 1 UNL1111111111 -0.5505 5 C -2.8740 -0.4077 -0.4304 C.3 1 UNL1111111111 -0.0096 6 C -2.0890 -0.8186 0.7744 C.3 1 UNL1111111111 -0.0097 7 C 1.6643 -0.1718 1.1095 C.3 1 UNL1111111111 -0.0039 8 C 2.3896 0.8472 0.2898 C.3 1 UNL1111111111 -0.0037 9 C -4.2073 0.3013 -0.2829 C.3 1 UNL1111111111 0.1485 10 C -0.6250 -0.9415 0.6659 C.2 1 UNL1111111111 -0.1672 11 C 0.2022 -0.0717 1.2521 C.2 1 UNL1111111111 -0.1740 12 C 3.7092 0.5028 -0.3797 C.3 1 UNL1111111111 0.1124 13 C -4.0748 1.6080 0.4955 C.3 1 UNL1111111111 -0.5009 14 C 3.5917 -0.7597 -1.1834 C.2 1 UNL1111111111 -0.1872 15 C 3.9955 -1.9446 -0.7316 C.2 1 UNL1111111111 -0.3011 16 H -2.3768 -0.2346 -1.3937 H 1 UNL1111111111 0.1804 17 H -2.4856 -0.6441 1.7813 H 1 UNL1111111111 0.1604 18 H 2.0987 -1.1685 1.2567 H 1 UNL1111111111 0.1646 19 H 1.8536 1.6821 -0.1798 H 1 UNL1111111111 0.1824 20 H -4.9763 -0.3752 0.1583 H 1 UNL1111111111 0.1366 21 H -0.2744 -1.7819 0.0630 H 1 UNL1111111111 0.1716 22 H -0.1470 0.7669 1.8574 H 1 UNL1111111111 0.1702 23 H 4.5385 0.4736 0.3674 H 1 UNL1111111111 0.1468 24 H -3.3585 2.2842 0.0087 H 1 UNL1111111111 0.1679 25 H -3.7269 1.4386 1.5203 H 1 UNL1111111111 0.1580 26 H -5.0315 2.1380 0.5586 H 1 UNL1111111111 0.1517 27 H 3.1366 -0.6241 -2.1654 H 1 UNL1111111111 0.1646 28 H -5.3889 1.1289 -1.6524 H 1 UNL1111111111 0.3182 29 H 4.7664 1.4662 -1.7592 H 1 UNL1111111111 0.3202 30 H 3.9026 -2.8597 -1.2989 H 1 UNL1111111111 0.1517 31 H 4.4504 -2.1020 0.2354 H 1 UNL1111111111 0.1482 @BOND 1 1 5 1 2 1 6 1 3 2 7 1 4 2 8 1 5 3 9 1 6 3 28 1 7 4 12 1 8 4 29 1 9 5 6 1 10 5 9 1 11 5 16 1 12 6 10 1 13 6 17 1 14 7 8 1 15 7 11 1 16 7 18 1 17 8 12 1 18 8 19 1 19 9 13 1 20 9 20 1 21 10 11 2 22 10 21 1 23 11 22 1 24 12 14 1 25 12 23 1 26 13 24 1 27 13 25 1 28 13 26 1 29 14 15 2 30 14 27 1 31 15 30 1 32 15 31 1