@MOLECULE 10-(3-aminopropyl)-8-chloro-3h-phenothiazine-2,3(10h)-dione 34 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 CL 4.9057 -0.1282 -0.4295 Cl 1 UNL1 -0.0645 2 S -0.6890 -2.6487 0.4799 S.2 1 UNL1 0.1866 3 O -4.6750 1.4226 0.4214 O.2 1 UNL1 -0.3616 4 O -4.9502 -0.7492 -1.3757 O.2 1 UNL1 -0.3314 5 N -0.0538 0.3510 0.6284 N.ar 1 UNL1 -0.3904 6 N 1.0647 4.9586 -0.7605 N.3 1 UNL1 -0.6429 7 C 0.2716 1.7232 1.0729 C.3 1 UNL1 -0.0815 8 C -1.3866 0.0551 0.3421 C.ar 1 UNL1 0.2821 9 C 1.0230 -0.4929 0.3008 C.ar 1 UNL1 0.2408 10 C 0.4124 2.6974 -0.1055 C.3 1 UNL1 -0.3188 11 C -1.7821 -1.3399 0.0681 C.ar 1 UNL1 -0.1028 12 C 0.8655 -1.8884 0.2194 C.ar 1 UNL1 -0.2351 13 C 1.0876 3.9976 0.3631 C.3 1 UNL1 -0.0920 14 C -2.3568 1.0110 0.3679 C.ar 1 UNL1 -0.4468 15 C 2.3075 0.0473 0.0850 C.ar 1 UNL1 -0.2836 16 C -3.0015 -1.6496 -0.3997 C.ar 1 UNL1 -0.2382 17 C 1.9487 -2.7229 -0.0546 C.ar 1 UNL1 -0.0573 18 C -3.7576 0.7124 0.1016 C.ar 1 UNL1 0.3856 19 C 3.3607 -0.8106 -0.1763 C.ar 1 UNL1 0.0867 20 C -4.0126 -0.5990 -0.6405 C.ar 1 UNL1 0.3388 21 C 3.2189 -2.1907 -0.2491 C.ar 1 UNL1 -0.2199 22 H -0.5205 2.0686 1.7819 H 1 UNL1 0.1660 23 H 1.2026 1.6903 1.6862 H 1 UNL1 0.1523 24 H -0.5789 2.9359 -0.5484 H 1 UNL1 0.1822 25 H 0.9804 2.2425 -0.9384 H 1 UNL1 0.1548 26 H 2.1127 3.7900 0.7376 H 1 UNL1 0.1071 27 H 0.5130 4.4424 1.2068 H 1 UNL1 0.1425 28 H -2.1682 2.0591 0.5945 H 1 UNL1 0.2001 29 H 2.4816 1.1232 0.1082 H 1 UNL1 0.1905 30 H -3.3261 -2.6652 -0.6416 H 1 UNL1 0.1948 31 H 1.8155 -3.8082 -0.1219 H 1 UNL1 0.1733 32 H 4.0681 -2.8405 -0.4575 H 1 UNL1 0.1825 33 H 1.6268 4.6499 -1.5355 H 1 UNL1 0.2498 34 H 1.3653 5.8757 -0.4795 H 1 UNL1 0.2502 @BOND 1 33 6 1 2 4 20 2 3 25 10 1 4 6 34 1 5 6 13 1 6 30 16 1 7 20 16 ar 8 20 18 ar 9 24 10 1 10 32 21 1 11 1 19 1 12 16 11 ar 13 21 19 ar 14 21 17 ar 15 19 15 ar 16 31 17 1 17 10 13 1 18 10 7 1 19 17 12 ar 20 11 8 1 21 11 2 ar 22 15 29 1 23 15 9 ar 24 18 14 ar 25 18 3 2 26 12 9 ar 27 12 2 ar 28 9 5 ar 29 8 14 ar 30 8 5 ar 31 13 26 1 32 13 27 1 33 14 28 1 34 5 7 1 35 7 23 1 36 7 22 1