@MOLECULE (3alpha)-17-acetoxy-3-hydroxy-16-(1-methyl-1-piperidiniumyl)-2-(4-morpholinyl)androstane 37 43 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 4.5938 -1.3204 -0.9839 O.3 1 UNL1 -0.3557 2 O -6.4800 1.7581 0.7077 O.2 1 UNL1 -0.2936 3 O -6.5145 -3.1948 1.0981 O.2 1 UNL1 0.1011 4 O 3.1529 -3.9301 -0.0250 O.3 1 UNL1 -0.0842 5 N 4.6165 1.0230 0.1287 N.ar 1 UNL1 -0.3937 6 N -5.2288 -0.7532 0.3887 N.pl3 1 UNL1 0.1272 7 C 1.1753 1.8525 -0.8223 C.1 1 UNL1 0.0956 8 C 2.2901 -1.7088 -0.7855 C.3 1 UNL1 -0.2700 9 C -0.1432 1.9300 -0.9220 C.2 1 UNL1 -0.0003 10 C -0.8397 0.6383 -1.3315 C.3 1 UNL1 -0.1592 11 C -2.3344 0.5288 -1.2619 C.2 1 UNL1 -0.4269 12 C 3.4089 0.6253 -0.4734 C.3 1 UNL1 0.1805 13 C 3.3417 -0.8301 -0.7786 C.3 1 UNL1 0.2790 14 C 2.3434 1.3860 -0.6825 C.1 1 UNL1 -0.1305 15 C -3.3552 3.4460 0.1796 C.2 1 UNL1 0.1069 16 C 1.0131 -1.1496 -0.9341 C.1 1 UNL1 -0.0405 17 C 0.0253 -0.4570 -1.1032 C.1 1 UNL1 -0.0431 18 C -1.0265 2.9385 -0.5492 C.1 1 UNL1 0.0291 19 C -2.0495 3.4955 -0.1768 C.2 1 UNL1 -0.0865 20 C -3.4175 0.4596 -0.5731 C.1 1 UNL1 0.3158 21 C 2.3094 -3.1713 -0.6286 C.3 1 UNL1 0.3577 22 C -4.3897 2.8229 0.3573 C.1 1 UNL1 -0.2057 23 C -4.5861 0.4609 0.0544 C.2 1 UNL1 -0.1680 24 C -1.7318 0.6075 -2.5983 C.3 1 UNL1 0.5322 25 C -5.3157 1.7507 0.4305 C.2 1 UNL1 0.5093 26 C 5.4958 -0.0002 0.7001 C.ar 1 UNL1 -0.1744 27 C 6.7542 3.0641 2.0972 C.3 1 UNL1 0.6095 28 C 4.9331 2.2828 0.5916 C.ar 1 UNL1 0.3641 29 C 5.3404 -1.2628 0.2698 C.3 1 UNL1 0.3316 30 C 6.1091 2.0848 1.4904 C.ar 1 UNL1 -0.9074 31 C 6.4290 0.6712 1.6264 C.ar 1 UNL1 0.2983 32 C 4.2947 -3.4275 0.4638 C.3 1 UNL1 0.1162 33 C -4.9012 -1.9307 -0.1398 C.2 1 UNL1 -0.2441 34 C -6.2315 -0.8895 1.3036 C.2 1 UNL1 -0.2092 35 C -5.5701 -3.0887 0.2398 C.2 1 UNL1 0.0911 36 C -6.8257 -1.9559 1.6186 C.2 1 UNL1 -0.0376 37 C 5.1586 -2.5803 0.6733 C.3 1 UNL1 -0.2144 @BOND 1 24 10 1 2 24 11 1 3 10 11 1 4 10 17 1 5 10 9 1 6 11 20 2 7 17 16 3 8 1 13 1 9 1 29 1 10 16 8 1 11 9 7 1 12 9 18 2 13 7 14 3 14 8 13 1 15 8 21 1 16 13 12 1 17 14 12 1 18 21 4 1 19 20 23 2 20 18 19 2 21 12 5 1 22 19 15 1 23 33 35 2 24 33 6 1 25 4 32 1 26 23 6 1 27 23 25 1 28 5 28 ar 29 5 26 ar 30 15 22 2 31 35 3 1 32 29 37 1 33 29 26 1 34 22 25 2 35 6 34 1 36 25 2 1 37 32 37 1 38 28 30 ar 39 26 31 ar 40 3 36 1 41 34 36 2 42 30 31 ar 43 30 27 1