@MOLECULE (1R,2R)-2-methoxy-1-phenyl-piperazine 30 31 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.0867 -1.3415 -0.7680 O.3 1 UNL111111111 -0.4134 2 N -0.3955 0.5463 0.3660 N.pl3 1 UNL111111111 -0.4575 3 N -3.2444 0.5926 0.0001 N.3 1 UNL111111111 -0.5188 4 C -1.1468 -0.7074 0.5021 C.3 1 UNL111111111 0.2633 5 C -1.0406 1.4840 -0.5811 C.3 1 UNL111111111 -0.0981 6 C -2.6343 -0.4374 0.8652 C.3 1 UNL111111111 -0.1547 7 C -2.4362 1.8305 -0.0129 C.3 1 UNL111111111 -0.1177 8 C 1.0070 0.3490 0.1749 C.ar 1 UNL111111111 0.2009 9 C 1.6707 0.6595 -1.0196 C.ar 1 UNL111111111 -0.2369 10 C 1.7415 -0.1124 1.2814 C.ar 1 UNL111111111 -0.2219 11 C -0.9343 -2.7435 -0.7223 C.3 1 UNL111111111 -0.1944 12 C 3.0534 0.5191 -1.0986 C.ar 1 UNL111111111 -0.1024 13 C 3.1204 -0.2528 1.1843 C.ar 1 UNL111111111 -0.1080 14 C 3.7815 0.0636 -0.0025 C.ar 1 UNL111111111 -0.1983 15 H -0.6710 -1.3429 1.2891 H 1 UNL111111111 0.1223 16 H -1.1527 1.0455 -1.5989 H 1 UNL111111111 0.1534 17 H -0.4229 2.4031 -0.6581 H 1 UNL111111111 0.1401 18 H -3.2056 -1.3801 0.7061 H 1 UNL111111111 0.1503 19 H -2.6871 -0.1782 1.9450 H 1 UNL111111111 0.1203 20 H -2.3295 2.2959 0.9903 H 1 UNL111111111 0.1251 21 H -2.9372 2.5648 -0.6790 H 1 UNL111111111 0.1394 22 H -4.2000 0.7838 0.2969 H 1 UNL111111111 0.2514 23 H 1.1128 0.9878 -1.8926 H 1 UNL111111111 0.1616 24 H 1.2304 -0.3361 2.2144 H 1 UNL111111111 0.1595 25 H -0.8779 -3.0173 -1.7849 H 1 UNL111111111 0.1506 26 H -1.8057 -3.2150 -0.2584 H 1 UNL111111111 0.1196 27 H -0.0086 -3.0271 -0.2119 H 1 UNL111111111 0.1211 28 H 3.5658 0.7628 -2.0284 H 1 UNL111111111 0.1478 29 H 3.6891 -0.6064 2.0427 H 1 UNL111111111 0.1459 30 H 4.8602 -0.0448 -0.0703 H 1 UNL111111111 0.1496 @BOND 1 1 4 1 2 1 11 1 3 2 4 1 4 2 5 1 5 2 8 1 6 3 6 1 7 3 7 1 8 3 22 1 9 4 6 1 10 4 15 1 11 5 7 1 12 5 16 1 13 5 17 1 14 6 18 1 15 6 19 1 16 7 20 1 17 7 21 1 18 8 9 ar 19 8 10 ar 20 9 12 ar 21 9 23 1 22 10 13 ar 23 10 24 1 24 11 25 1 25 11 26 1 26 11 27 1 27 12 14 ar 28 12 28 1 29 13 14 ar 30 13 29 1 31 14 30 1