@MOLECULE tetrahydroisoquinoline 21 22 0 0 0 SMALL USER_CHARGES @ATOM 1 N -2.4078 0.6165 -0.2578 N.3 1 UNL11111111 -0.5358 2 C -1.1621 -1.4860 -0.1816 C.3 1 UNL11111111 -0.2883 3 C 0.1128 -0.7134 -0.0764 C.ar 1 UNL11111111 0.0136 4 C -2.3239 -0.6861 0.4354 C.3 1 UNL11111111 -0.1007 5 C 0.0844 0.6830 -0.0254 C.ar 1 UNL11111111 -0.0241 6 C -1.2060 1.4559 -0.0385 C.3 1 UNL11111111 -0.1189 7 C 1.3369 -1.3855 -0.0513 C.ar 1 UNL11111111 -0.1782 8 C 1.2823 1.3981 0.0505 C.ar 1 UNL11111111 -0.1757 9 C 2.5274 -0.6678 0.0240 C.ar 1 UNL11111111 -0.1480 10 C 2.5002 0.7249 0.0750 C.ar 1 UNL11111111 -0.1521 11 H -1.3800 -1.6776 -1.2573 H 1 UNL11111111 0.1718 12 H -1.0838 -2.4768 0.3019 H 1 UNL11111111 0.1455 13 H -3.2841 -1.2223 0.2729 H 1 UNL11111111 0.1377 14 H -2.1769 -0.5891 1.5321 H 1 UNL11111111 0.1158 15 H -1.2783 2.0523 0.9012 H 1 UNL11111111 0.1233 16 H -1.1879 2.1854 -0.8883 H 1 UNL11111111 0.1592 17 H -3.2448 1.1240 0.0265 H 1 UNL11111111 0.2540 18 H 1.3596 -2.4723 -0.0930 H 1 UNL11111111 0.1515 19 H 1.2652 2.4852 0.0879 H 1 UNL11111111 0.1504 20 H 3.4786 -1.1945 0.0426 H 1 UNL11111111 0.1489 21 H 3.4302 1.2860 0.1333 H 1 UNL11111111 0.1499 @BOND 1 11 2 1 2 16 6 1 3 1 6 1 4 1 17 1 5 1 4 1 6 2 3 1 7 2 12 1 8 2 4 1 9 18 7 1 10 3 7 ar 11 3 5 ar 12 7 9 ar 13 6 5 1 14 6 15 1 15 5 8 ar 16 9 20 1 17 9 10 ar 18 8 10 ar 19 8 19 1 20 10 21 1 21 13 4 1 22 4 14 1