@MOLECULE 2-isopropoxyphenol 23 23 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.1105 -0.1813 0.6370 O.3 1 UNL1111111111 -0.3969 2 O 0.5441 -2.2258 0.0106 O.3 1 UNL1111111111 -0.4560 3 C -2.1351 0.5674 -0.0401 C.3 1 UNL1111111111 0.1703 4 C -2.0495 0.3326 -1.5431 C.3 1 UNL1111111111 -0.5015 5 C -3.4118 -0.0028 0.5724 C.3 1 UNL1111111111 -0.4713 6 C 0.1778 0.1444 0.3192 C.ar 1 UNL1111111111 0.0919 7 C 1.0158 -0.9542 0.0431 C.ar 1 UNL1111111111 0.2125 8 C 0.6987 1.4312 0.3488 C.ar 1 UNL1111111111 -0.1904 9 C 2.3731 -0.7688 -0.2052 C.ar 1 UNL1111111111 -0.2135 10 C 2.0596 1.6163 0.0958 C.ar 1 UNL1111111111 -0.1749 11 C 2.8853 0.5282 -0.1788 C.ar 1 UNL1111111111 -0.1268 12 H -2.0050 1.6415 0.2161 H 1 UNL1111111111 0.1198 13 H -2.8839 0.8070 -2.0708 H 1 UNL1111111111 0.1576 14 H -1.1185 0.7379 -1.9602 H 1 UNL1111111111 0.1602 15 H -2.0687 -0.7375 -1.7842 H 1 UNL1111111111 0.1619 16 H -4.2956 0.5336 0.2124 H 1 UNL1111111111 0.1546 17 H -3.3895 0.0747 1.6682 H 1 UNL1111111111 0.1634 18 H -3.5368 -1.0649 0.3293 H 1 UNL1111111111 0.1590 19 H 0.0602 2.2807 0.5744 H 1 UNL1111111111 0.1598 20 H 3.0065 -1.6271 -0.4156 H 1 UNL1111111111 0.1751 21 H 2.4760 2.6207 0.1178 H 1 UNL1111111111 0.1529 22 H 3.9447 0.6881 -0.3739 H 1 UNL1111111111 0.1523 23 H -0.4311 -2.2361 0.2121 H 1 UNL1111111111 0.3399 @BOND 1 1 3 1 2 1 6 1 3 2 7 1 4 2 23 1 5 3 4 1 6 3 5 1 7 3 12 1 8 4 13 1 9 4 14 1 10 4 15 1 11 5 16 1 12 5 17 1 13 5 18 1 14 6 7 ar 15 6 8 ar 16 7 9 ar 17 8 10 ar 18 8 19 1 19 9 11 ar 20 9 20 1 21 10 11 ar 22 10 21 1 23 11 22 1