@MOLECULE (1r,2r)-2-amino-1,2-diphenylethanol 31 32 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.3889 2.7359 0.0044 O.3 1 UNL1111111111 -0.5709 2 N 1.4916 2.7951 -0.0166 N.3 1 UNL1111111111 -0.6536 3 C 0.6411 1.6708 0.4446 C.3 1 UNL1111111111 0.0225 4 C -0.6166 1.6451 -0.4773 C.3 1 UNL1111111111 0.1295 5 C 1.3957 0.3709 0.3219 C.ar 1 UNL1111111111 -0.0337 6 C -1.3764 0.3570 -0.3386 C.ar 1 UNL1111111111 -0.0822 7 C 1.2579 -0.6014 1.3142 C.ar 1 UNL1111111111 -0.1600 8 C 2.1977 0.1212 -0.7926 C.ar 1 UNL1111111111 -0.1349 9 C -1.1991 -0.6586 -1.2788 C.ar 1 UNL1111111111 -0.1440 10 C -2.2328 0.1668 0.7449 C.ar 1 UNL1111111111 -0.1443 11 C 1.9072 -1.8265 1.1816 C.ar 1 UNL1111111111 -0.1469 12 C 2.8485 -1.1034 -0.9204 C.ar 1 UNL1111111111 -0.1550 13 C -1.8683 -1.8704 -1.1228 C.ar 1 UNL1111111111 -0.1458 14 C -2.9055 -1.0441 0.8958 C.ar 1 UNL1111111111 -0.1489 15 C 2.6999 -2.0795 0.0635 C.ar 1 UNL1111111111 -0.1496 16 C -2.7199 -2.0638 -0.0359 C.ar 1 UNL1111111111 -0.1440 17 H 0.2882 1.8225 1.5006 H 1 UNL1111111111 0.1393 18 H -0.3351 1.8669 -1.5332 H 1 UNL1111111111 0.1477 19 H 2.3152 2.8941 0.5533 H 1 UNL1111111111 0.2532 20 H 0.9700 3.6609 -0.0109 H 1 UNL1111111111 0.2657 21 H 0.6330 -0.4119 2.1847 H 1 UNL1111111111 0.1520 22 H 2.3134 0.8940 -1.5552 H 1 UNL1111111111 0.1727 23 H -0.5249 -0.5136 -2.1215 H 1 UNL1111111111 0.1556 24 H -2.3665 0.9650 1.4755 H 1 UNL1111111111 0.1634 25 H -2.2610 2.7604 -0.4345 H 1 UNL1111111111 0.3236 26 H 1.7911 -2.5870 1.9506 H 1 UNL1111111111 0.1486 27 H 3.4721 -1.2975 -1.7898 H 1 UNL1111111111 0.1470 28 H -1.7210 -2.6679 -1.8479 H 1 UNL1111111111 0.1498 29 H -3.5708 -1.1943 1.7436 H 1 UNL1111111111 0.1496 30 H 3.2030 -3.0379 -0.0402 H 1 UNL1111111111 0.1459 31 H -3.2381 -3.0126 0.0851 H 1 UNL1111111111 0.1478 @BOND 1 1 4 1 2 1 25 1 3 2 3 1 4 2 19 1 5 2 20 1 6 3 4 1 7 3 5 1 8 3 17 1 9 4 6 1 10 4 18 1 11 5 7 ar 12 5 8 ar 13 6 9 ar 14 6 10 ar 15 7 11 ar 16 7 21 1 17 8 12 ar 18 8 22 1 19 9 13 ar 20 9 23 1 21 10 14 ar 22 10 24 1 23 11 15 ar 24 11 26 1 25 12 15 ar 26 12 27 1 27 13 16 ar 28 13 28 1 29 14 16 ar 30 14 29 1 31 15 30 1 32 16 31 1