@MOLECULE 3-(chloroacetyl)-1h-indole 21 22 0 0 0 SMALL USER_CHARGES @ATOM 1 CL -4.0837 0.2493 0.0114 Cl 1 UNL11111111 -0.0974 2 O -1.4979 1.4196 -0.0111 O.2 1 UNL11111111 -0.4036 3 N 1.5089 -2.0719 0.0008 N.ar 1 UNL11111111 -0.3487 4 C 1.1870 0.1945 -0.0037 C.ar 1 UNL11111111 -0.0084 5 C 2.1746 -0.8395 0.0013 C.ar 1 UNL11111111 0.0772 6 C -0.0964 -0.4601 -0.0068 C.ar 1 UNL11111111 -0.2818 7 C 0.1452 -1.8335 -0.0046 C.ar 1 UNL11111111 0.0272 8 C 1.6085 1.5298 -0.0032 C.ar 1 UNL11111111 -0.1000 9 C 3.5484 -0.5752 0.0082 C.ar 1 UNL11111111 -0.2098 10 C -1.3839 0.2190 -0.0102 C.2 1 UNL11111111 0.4787 11 C 2.9672 1.7890 0.0017 C.ar 1 UNL11111111 -0.1784 12 C 3.9274 0.7533 0.0079 C.ar 1 UNL11111111 -0.1147 13 C -2.5945 -0.6953 -0.0094 C.3 1 UNL11111111 -0.3137 14 H 1.9515 -2.9620 0.0023 H 1 UNL11111111 0.3154 15 H -0.5575 -2.6499 -0.0069 H 1 UNL11111111 0.1664 16 H 0.8698 2.3348 -0.0070 H 1 UNL11111111 0.1817 17 H 4.2752 -1.3790 0.0133 H 1 UNL11111111 0.1563 18 H 3.3222 2.8185 0.0003 H 1 UNL11111111 0.1568 19 H 4.9842 1.0171 0.0123 H 1 UNL11111111 0.1522 20 H -2.6121 -1.3414 0.8841 H 1 UNL11111111 0.1720 21 H -2.6283 -1.3280 -0.9116 H 1 UNL11111111 0.1723 @BOND 1 21 13 1 2 2 10 2 3 10 13 1 4 10 6 1 5 13 1 1 6 13 20 1 7 16 8 1 8 15 7 1 9 6 7 ar 10 6 4 ar 11 7 3 ar 12 4 8 ar 13 4 5 ar 14 8 11 ar 15 5 3 ar 16 5 9 ar 17 18 11 1 18 3 14 1 19 11 12 ar 20 12 9 ar 21 12 19 1 22 9 17 1