@MOLECULE [(1r)-5,8-dichloro-1-propyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl]acetic acid 39 41 0 0 0 SMALL GASTEIGER @ATOM 1 C 1.4252 0.6852 0.3554 C.ar 1 UNL11111 0.0856 2 C 2.6149 1.3913 0.5752 C.ar 1 UNL11111 -0.0484 3 C 3.8273 0.7437 0.5339 C.ar 1 UNL11111 -0.1186 4 C 3.8790 -0.6427 0.2628 C.ar 1 UNL11111 -0.2051 5 C 2.7145 -1.3421 0.0354 C.ar 1 UNL11111 0.0642 6 C 1.4635 -0.7247 0.0686 C.ar 1 UNL11111 -0.1042 7 N 0.1000 1.0966 0.3899 N.ar 1 UNL11111 -0.3218 8 C -0.6884 -0.0096 0.0666 C.ar 1 UNL11111 -0.0187 9 C 0.1066 -1.1341 -0.1168 C.ar 1 UNL11111 -0.0470 10 C -2.1811 -0.0366 0.0124 C.3 1 UNL11111 0.2939 11 O -2.5970 -1.2354 -0.6269 O.3 1 UNL11111 -0.3942 12 C -1.9729 -2.4319 -0.1939 C.3 1 UNL11111 -0.0263 13 C -0.4620 -2.4431 -0.4826 C.3 1 UNL11111 -0.2967 14 CL 2.5200 3.0631 0.8849 Cl 1 UNL11111 -0.0655 15 CL 2.7853 -3.0122 -0.3025 Cl 1 UNL11111 -0.0724 16 C -2.8010 1.0553 -0.8869 C.3 1 UNL11111 -0.3844 17 C -1.9172 1.4319 -2.0321 C.2 1 UNL11111 0.6573 18 O -1.8751 1.0113 -3.1522 O.2 1 UNL11111 -0.4611 19 O -1.0964 2.4605 -1.6492 O.3 1 UNL11111 -0.6099 20 C -2.7393 0.0348 1.4497 C.3 1 UNL11111 -0.3257 21 C -4.2489 -0.2159 1.4896 C.3 1 UNL11111 -0.2387 22 C -4.7392 -0.3153 2.9337 C.3 1 UNL11111 -0.4421 23 H 4.7603 1.2834 0.7054 H 1 UNL11111 0.1750 24 H 4.8500 -1.1373 0.2348 H 1 UNL11111 0.1777 25 H -0.2149 2.0475 0.3392 H 1 UNL11111 0.3393 26 H -2.1815 -2.5933 0.8775 H 1 UNL11111 0.1223 27 H -2.5145 -3.1855 -0.7967 H 1 UNL11111 0.1454 28 H -0.2758 -2.6416 -1.5633 H 1 UNL11111 0.1756 29 H 0.0218 -3.2776 0.0641 H 1 UNL11111 0.1665 30 H -3.7683 0.6668 -1.2931 H 1 UNL11111 0.2038 31 H -3.0548 1.9515 -0.2814 H 1 UNL11111 0.1882 32 H -0.4750 2.7585 -2.3559 H 1 UNL11111 0.3645 33 H -2.2185 -0.7139 2.0807 H 1 UNL11111 0.1598 34 H -2.4946 1.0132 1.9026 H 1 UNL11111 0.1505 35 H -4.7911 0.5913 0.9631 H 1 UNL11111 0.1329 36 H -4.4904 -1.1478 0.9393 H 1 UNL11111 0.1509 37 H -4.2616 -1.1458 3.4655 H 1 UNL11111 0.1432 38 H -4.5272 0.6011 3.4958 H 1 UNL11111 0.1432 39 H -5.8212 -0.4821 2.9747 H 1 UNL11111 0.1410 @BOND 1 1 6 ar 2 2 3 ar 3 2 1 ar 4 3 4 ar 5 3 23 1 6 4 5 ar 7 4 24 1 8 5 15 1 9 6 9 ar 10 6 5 ar 11 7 1 ar 12 7 8 ar 13 7 25 1 14 8 9 ar 15 9 13 1 16 10 8 1 17 10 11 1 18 10 16 1 19 11 12 1 20 12 26 1 21 12 27 1 22 13 12 1 23 13 28 1 24 13 29 1 25 14 2 1 26 16 30 1 27 16 31 1 28 17 16 1 29 17 19 1 30 18 17 2 31 19 32 1 32 20 10 1 33 20 33 1 34 20 34 1 35 21 20 1 36 21 35 1 37 21 36 1 38 22 21 1 39 22 37 1 40 22 38 1 41 22 39 1