@MOLECULE 4-(dimethylamino)-1-naphthyl isothiocyanate 28 29 0 0 0 SMALL GASTEIGER @ATOM 1 S -5.0372 0.3544 0.1826 S.2 1 UNL1111111111 -0.2428 2 N 3.2042 1.2786 0.0740 N.pl3 1 UNL1111111111 -0.3972 3 N -2.3233 0.3932 -0.2618 N.2 1 UNL1111111111 -0.3887 4 C 1.2821 -0.4070 -0.0128 C.ar 1 UNL1111111111 -0.0382 5 C 1.8085 0.9266 -0.0066 C.ar 1 UNL1111111111 0.1318 6 C -0.1172 -0.5935 -0.0954 C.ar 1 UNL1111111111 -0.0360 7 C 0.9603 2.0132 -0.0817 C.ar 1 UNL1111111111 -0.1470 8 C -0.9608 0.5651 -0.1637 C.ar 1 UNL1111111111 0.2088 9 C 2.1087 -1.5617 0.0602 C.ar 1 UNL1111111111 -0.1608 10 C -0.4336 1.8425 -0.1618 C.ar 1 UNL1111111111 -0.1834 11 C -0.6544 -1.9087 -0.1082 C.ar 1 UNL1111111111 -0.1339 12 C 3.8237 0.8706 1.3498 C.3 1 UNL1111111111 -0.2679 13 C 3.9726 0.8346 -1.1050 C.3 1 UNL1111111111 -0.2680 14 C 1.5717 -2.8231 0.0492 C.ar 1 UNL1111111111 -0.1331 15 C 0.1705 -3.0007 -0.0372 C.ar 1 UNL1111111111 -0.1365 16 C -3.4848 0.4135 0.0014 C.1 1 UNL1111111111 0.3409 17 H 1.3766 3.0250 -0.0781 H 1 UNL1111111111 0.1839 18 H 3.1889 -1.4367 0.1258 H 1 UNL1111111111 0.1561 19 H -1.0788 2.7195 -0.2218 H 1 UNL1111111111 0.1782 20 H -1.7359 -2.0388 -0.1788 H 1 UNL1111111111 0.1675 21 H 4.0098 -0.2072 1.4588 H 1 UNL1111111111 0.1217 22 H 3.1803 1.1955 2.1861 H 1 UNL1111111111 0.1535 23 H 4.7862 1.4027 1.4481 H 1 UNL1111111111 0.1504 24 H 4.1396 -0.2494 -1.1763 H 1 UNL1111111111 0.1219 25 H 4.9544 1.3390 -1.0859 H 1 UNL1111111111 0.1501 26 H 3.4503 1.1635 -2.0206 H 1 UNL1111111111 0.1539 27 H 2.2130 -3.7021 0.1056 H 1 UNL1111111111 0.1552 28 H -0.2354 -4.0109 -0.0469 H 1 UNL1111111111 0.1594 @BOND 1 1 16 2 2 2 5 1 3 2 12 1 4 2 13 1 5 3 8 1 6 3 16 2 7 4 5 ar 8 4 6 ar 9 4 9 ar 10 5 7 ar 11 6 8 ar 12 6 11 ar 13 7 10 ar 14 7 17 1 15 8 10 ar 16 9 14 ar 17 9 18 1 18 10 19 1 19 11 15 ar 20 11 20 1 21 12 21 1 22 12 22 1 23 12 23 1 24 13 24 1 25 13 25 1 26 13 26 1 27 14 15 ar 28 14 27 1 29 15 28 1