@MOLECULE hydrochlorothiazide 25 26 0 0 0 SMALL USER_CHARGES @ATOM 1 CL -2.6615 -2.1405 0.0299 Cl 1 UNL11111111 -0.0467 2 S 2.7356 0.9707 -0.0099 S.O2 1 UNL11111111 2.3674 3 S -2.6497 1.0994 -0.1233 S.O2 1 UNL11111111 2.3815 4 O 3.0901 1.3272 -1.3559 O.2 1 UNL11111111 -0.8587 5 O 2.7189 1.9379 1.0569 O.2 1 UNL11111111 -0.8758 6 O -2.2525 2.4821 0.0116 O.2 1 UNL11111111 -0.9166 7 O -3.4764 0.6519 -1.2154 O.2 1 UNL11111111 -0.8977 8 N 3.8591 -0.2704 0.5178 N.3 1 UNL11111111 -0.8654 9 N 2.3547 -2.1101 0.0334 N.pl3 1 UNL11111111 -0.6006 10 N -3.5064 0.6920 1.3283 N.3 1 UNL11111111 -0.9511 11 C 1.2368 0.0697 -0.0218 C.ar 1 UNL11111111 -0.5928 12 C 1.2187 -1.3456 -0.0002 C.ar 1 UNL11111111 0.3843 13 C 3.7206 -1.5385 -0.1534 C.3 1 UNL11111111 0.1375 14 C 0.0384 0.7784 -0.0429 C.ar 1 UNL11111111 0.1149 15 C -1.1935 0.1248 -0.0456 C.ar 1 UNL11111111 -0.5283 16 C -0.0344 -2.0167 0.0234 C.ar 1 UNL11111111 -0.3917 17 C -1.1918 -1.2705 -0.0025 C.ar 1 UNL11111111 0.2180 18 H 4.4590 -2.2840 0.2382 H 1 UNL11111111 0.1487 19 H 3.9049 -1.4087 -1.2589 H 1 UNL11111111 0.1669 20 H 0.0591 1.8880 -0.0500 H 1 UNL11111111 0.1987 21 H 4.0869 -0.3090 1.5059 H 1 UNL11111111 0.3154 22 H 2.2772 -3.1154 0.0719 H 1 UNL11111111 0.3178 23 H -0.0645 -3.1022 0.0547 H 1 UNL11111111 0.1773 24 H -3.5779 1.4075 2.0322 H 1 UNL11111111 0.2974 25 H -4.3819 0.2057 1.2205 H 1 UNL11111111 0.2998 @BOND 1 4 2 2 2 19 13 1 3 7 3 2 4 13 9 1 5 13 18 1 6 13 8 1 7 3 15 1 8 3 6 2 9 3 10 1 10 20 14 1 11 15 14 ar 12 15 17 ar 13 14 11 ar 14 11 2 1 15 11 12 ar 16 2 8 1 17 2 5 2 18 17 16 ar 19 17 1 1 20 12 16 ar 21 12 9 1 22 16 23 1 23 9 22 1 24 8 21 1 25 25 10 1 26 10 24 1