@MOLECULE 3-(phenoxymethyl)benzoic acid 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 C -3.9928 -1.0626 -0.2421 C.2 1 UNL1111111111 0.6424 2 C -2.9805 -0.0265 0.0037 C.ar 1 UNL1111111111 -0.1542 3 C -1.7091 -0.4446 0.4056 C.ar 1 UNL1111111111 -0.0742 4 C -0.7213 0.5073 0.6460 C.ar 1 UNL1111111111 -0.0590 5 C -0.9974 1.8654 0.4694 C.ar 1 UNL1111111111 -0.0780 6 C -2.2675 2.2746 0.0676 C.ar 1 UNL1111111111 -0.1871 7 C -3.2648 1.3298 -0.1654 C.ar 1 UNL1111111111 -0.0597 8 O -5.1601 -0.5347 -0.7011 O.3 1 UNL1111111111 -0.5586 9 O -3.8883 -2.2530 -0.0856 O.2 1 UNL1111111111 -0.5021 10 C 0.6542 0.0798 1.0606 C.3 1 UNL1111111111 -0.0548 11 O 1.4656 0.4806 -0.0502 O.3 1 UNL1111111111 -0.3328 12 C 2.7601 0.0665 -0.0587 C.ar 1 UNL1111111111 0.2535 13 C 3.4152 0.3726 -1.2631 C.ar 1 UNL1111111111 -0.2487 14 C 4.7500 0.0220 -1.4006 C.ar 1 UNL1111111111 -0.0785 15 C 5.4239 -0.6235 -0.3592 C.ar 1 UNL1111111111 -0.2249 16 C 4.7568 -0.9172 0.8258 C.ar 1 UNL1111111111 -0.0741 17 C 3.4137 -0.5754 0.9914 C.ar 1 UNL1111111111 -0.3028 18 H -1.5015 -1.5127 0.5210 H 1 UNL1111111111 0.1775 19 H -0.2108 2.6030 0.6367 H 1 UNL1111111111 0.1618 20 H -2.4800 3.3334 -0.0697 H 1 UNL1111111111 0.1592 21 H -4.2616 1.6464 -0.4825 H 1 UNL1111111111 0.1734 22 H -5.8489 -1.2221 -0.8834 H 1 UNL1111111111 0.3575 23 H 1.0041 0.6098 1.9669 H 1 UNL1111111111 0.1387 24 H 0.7388 -1.0123 1.2145 H 1 UNL1111111111 0.1425 25 H 2.8708 0.8708 -2.0608 H 1 UNL1111111111 0.1724 26 H 5.2773 0.2486 -2.3272 H 1 UNL1111111111 0.1503 27 H 6.4688 -0.8958 -0.4789 H 1 UNL1111111111 0.1539 28 H 5.2848 -1.4194 1.6358 H 1 UNL1111111111 0.1464 29 H 2.9094 -0.8075 1.9215 H 1 UNL1111111111 0.1602 @BOND 1 1 8 1 2 2 1 1 3 2 3 ar 4 3 18 1 5 4 3 ar 6 4 10 1 7 5 4 ar 8 5 19 1 9 6 5 ar 10 6 7 ar 11 6 20 1 12 7 2 ar 13 7 21 1 14 8 22 1 15 9 1 2 16 10 23 1 17 10 24 1 18 11 10 1 19 12 11 1 20 13 12 ar 21 13 25 1 22 14 13 ar 23 14 26 1 24 15 14 ar 25 15 16 ar 26 15 27 1 27 16 17 ar 28 16 28 1 29 17 12 ar 30 17 29 1