@MOLECULE (3r,4as,6s,8as)-6-[2-(2h-tetrazol-5-yl)ethyl]decahydro-3-isoquinolinecarboxylic acid 41 43 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.9591 2.7405 -0.6445 O.3 1 UNL1111111111 -0.5763 2 OXT 5.3959 1.6685 0.6755 O.2 1 UNL1111111111 -0.4797 3 N 3.6424 -0.4527 0.9973 N.3 1 UNL1111111111 -0.5400 4 N -4.3725 1.7815 0.2926 N.ar 1 UNL1111111111 -0.2654 5 N -5.3001 -0.2108 -0.1637 N.ar 1 UNL1111111111 -0.2414 6 N -5.6613 1.7127 0.7008 N.ar 1 UNL1111111111 -0.1355 7 N -6.2043 0.5030 0.4173 N.ar 1 UNL1111111111 -0.0193 8 C 1.5759 -0.7351 -1.0610 C.3 1 UNL1111111111 -0.1043 9 C 2.1202 -1.9340 -0.2603 C.3 1 UNL1111111111 -0.1164 10 C 0.2547 -0.2103 -0.4788 C.3 1 UNL1111111111 -0.2893 11 C -0.7951 -1.3333 -0.4517 C.3 1 UNL1111111111 -0.0910 12 C 1.0541 -3.0337 -0.1509 C.3 1 UNL1111111111 -0.2902 13 C -0.2765 -2.5068 0.3997 C.3 1 UNL1111111111 -0.2774 14 C 2.6462 0.3645 -1.1116 C.3 1 UNL1111111111 -0.2885 15 C 2.6052 -1.4962 1.1414 C.3 1 UNL1111111111 -0.1116 16 CA 3.1384 0.7465 0.2989 C.3 1 UNL1111111111 -0.0118 17 C -2.1241 -0.8258 0.1339 C.3 1 UNL1111111111 -0.2851 18 C -2.8524 0.1024 -0.8517 C.3 1 UNL1111111111 -0.2527 19 C 4.3136 1.7015 0.1611 C.2 1 UNL1111111111 0.6145 20 C -4.1232 0.5663 -0.2600 C.ar 1 UNL1111111111 0.1590 21 H 1.3804 -1.0771 -2.1083 H 1 UNL1111111111 0.1346 22 H 3.0069 -2.3427 -0.8078 H 1 UNL1111111111 0.1484 23 H -0.1063 0.6417 -1.0832 H 1 UNL1111111111 0.1372 24 H 0.4089 0.1873 0.5402 H 1 UNL1111111111 0.1407 25 H -0.9684 -1.6970 -1.4921 H 1 UNL1111111111 0.1373 26 H 1.4248 -3.8586 0.4860 H 1 UNL1111111111 0.1365 27 H 0.8895 -3.4817 -1.1501 H 1 UNL1111111111 0.1389 28 H -1.0227 -3.3236 0.4143 H 1 UNL1111111111 0.1380 29 H -0.1562 -2.1890 1.4516 H 1 UNL1111111111 0.1377 30 H 2.2603 1.2631 -1.6299 H 1 UNL1111111111 0.1575 31 H 3.5071 0.0060 -1.7128 H 1 UNL1111111111 0.1592 32 H 1.7466 -1.1746 1.7643 H 1 UNL1111111111 0.1172 33 H 3.0878 -2.3623 1.6495 H 1 UNL1111111111 0.1419 34 HA 2.3181 1.2740 0.8557 H 1 UNL1111111111 0.1451 35 H -1.9451 -0.3000 1.0909 H 1 UNL1111111111 0.1484 36 H -2.7804 -1.6857 0.3811 H 1 UNL1111111111 0.1567 37 H 4.0328 -0.2001 1.9092 H 1 UNL1111111111 0.2693 38 H -3.0495 -0.4363 -1.8073 H 1 UNL1111111111 0.1745 39 H -2.2074 0.9705 -1.1162 H 1 UNL1111111111 0.1734 40 H 4.6811 3.4000 -0.7809 H 1 UNL1111111111 0.3561 41 H -6.1277 2.4807 1.1494 H 1 UNL1111111111 0.3540 @BOND 1 1 19 1 2 1 40 1 3 2 19 2 4 3 15 1 5 3 16 1 6 3 37 1 7 4 6 ar 8 4 20 ar 9 5 7 ar 10 5 20 ar 11 6 7 ar 12 6 41 1 13 8 9 1 14 8 10 1 15 8 14 1 16 8 21 1 17 9 12 1 18 9 15 1 19 9 22 1 20 10 11 1 21 10 23 1 22 10 24 1 23 11 13 1 24 11 17 1 25 11 25 1 26 12 13 1 27 12 26 1 28 12 27 1 29 13 28 1 30 13 29 1 31 14 16 1 32 14 30 1 33 14 31 1 34 15 32 1 35 15 33 1 36 16 19 1 37 16 34 1 38 17 18 1 39 17 35 1 40 17 36 1 41 18 20 1 42 18 38 1 43 18 39 1