@MOLECULE (2r)-2-benzyl-2-hydroxysuccinic acid 28 28 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.6955 0.3152 1.5809 O.3 1 UNL1111111111 -0.5376 2 O 2.1429 1.6258 -1.3930 O.3 1 UNL1111111111 -0.5825 3 O 2.9133 1.6938 0.6996 O.2 1 UNL1111111111 -0.4473 4 O 2.0990 -2.6159 -1.0774 O.3 1 UNL1111111111 -0.5419 5 O 2.2935 -1.7786 0.9793 O.2 1 UNL1111111111 -0.5253 6 C 0.7687 0.5573 0.2096 C.3 1 UNL1111111111 0.2843 7 C -0.4340 1.4626 -0.1180 C.3 1 UNL1111111111 -0.3119 8 C 0.7706 -0.7460 -0.6069 C.3 1 UNL1111111111 -0.4240 9 C -1.7301 0.7150 -0.0652 C.ar 1 UNL1111111111 0.0035 10 C 2.0626 1.3427 -0.0638 C.2 1 UNL1111111111 0.5576 11 C -2.4805 0.5300 -1.2279 C.ar 1 UNL1111111111 -0.1770 12 C -2.1935 0.2038 1.1496 C.ar 1 UNL1111111111 -0.1466 13 C 1.7855 -1.7198 -0.1144 C.2 1 UNL1111111111 0.6575 14 C -3.6889 -0.1618 -1.1751 C.ar 1 UNL1111111111 -0.1489 15 C -3.3997 -0.4895 1.1982 C.ar 1 UNL1111111111 -0.1481 16 C -4.1494 -0.6725 0.0369 C.ar 1 UNL1111111111 -0.1569 17 H -0.4600 2.3001 0.6192 H 1 UNL1111111111 0.1833 18 H -0.2822 1.9409 -1.1093 H 1 UNL1111111111 0.1728 19 H -0.2415 -1.2231 -0.5471 H 1 UNL1111111111 0.2158 20 H 0.9099 -0.5258 -1.6921 H 1 UNL1111111111 0.2140 21 H 1.4014 -0.3232 1.8701 H 1 UNL1111111111 0.3623 22 H -2.1283 0.9278 -2.1771 H 1 UNL1111111111 0.1510 23 H -1.6019 0.3440 2.0579 H 1 UNL1111111111 0.1781 24 H -4.2743 -0.3020 -2.0815 H 1 UNL1111111111 0.1472 25 H -3.7589 -0.8879 2.1452 H 1 UNL1111111111 0.1508 26 H -5.0930 -1.2119 0.0773 H 1 UNL1111111111 0.1494 27 H 2.9481 2.1382 -1.6463 H 1 UNL1111111111 0.3593 28 H 2.7607 -3.2962 -0.7875 H 1 UNL1111111111 0.3611 @BOND 1 1 6 1 2 1 21 1 3 2 10 1 4 2 27 1 5 3 10 2 6 4 13 1 7 4 28 1 8 5 13 2 9 6 7 1 10 6 8 1 11 6 10 1 12 7 9 1 13 7 17 1 14 7 18 1 15 8 13 1 16 8 19 1 17 8 20 1 18 9 11 ar 19 9 12 ar 20 11 14 ar 21 11 22 1 22 12 15 ar 23 12 23 1 24 14 16 ar 25 14 24 1 26 15 16 ar 27 15 25 1 28 16 26 1