@MOLECULE phenyl beta-d-glucopyranoside 34 35 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2155 0.5778 -0.0102 O.3 1 UNL1111111111 -0.4593 2 O 3.5716 -1.6956 -0.5766 O.3 1 UNL1111111111 -0.5561 3 O 3.7876 1.1896 -0.3794 O.3 1 UNL1111111111 -0.5374 4 O -0.9493 -1.3178 -0.1676 O.3 1 UNL1111111111 -0.3459 5 O 1.3553 -2.6287 1.1089 O.3 1 UNL1111111111 -0.5426 6 O 0.3662 3.4278 0.3728 O.3 1 UNL1111111111 -0.5370 7 C 2.6808 -0.8813 0.1570 C.3 1 UNL1111111111 0.0400 8 C 2.5648 0.5085 -0.4863 C.3 1 UNL1111111111 0.0357 9 C 1.3379 -1.6337 0.1069 C.3 1 UNL1111111111 0.0650 10 C 1.4245 1.2772 0.2004 C.3 1 UNL1111111111 0.0220 11 C 0.1458 -0.7371 0.5130 C.3 1 UNL1111111111 0.2897 12 C 1.1684 2.6361 -0.4714 C.3 1 UNL1111111111 -0.0115 13 C -2.1553 -0.6782 -0.0837 C.ar 1 UNL1111111111 0.2691 14 C -2.4734 0.3136 0.8428 C.ar 1 UNL1111111111 -0.2810 15 C -3.0893 -1.1530 -1.0145 C.ar 1 UNL1111111111 -0.2437 16 C -3.7660 0.8354 0.8361 C.ar 1 UNL1111111111 -0.0855 17 C -4.3692 -0.6131 -1.0016 C.ar 1 UNL1111111111 -0.0850 18 C -4.7100 0.3792 -0.0799 C.ar 1 UNL1111111111 -0.2143 19 H 3.0696 -0.8280 1.2002 H 1 UNL1111111111 0.1436 20 H 2.4192 0.4387 -1.5909 H 1 UNL1111111111 0.1779 21 H 1.1732 -2.1056 -0.8904 H 1 UNL1111111111 0.1692 22 H 1.5940 1.4005 1.2925 H 1 UNL1111111111 0.1408 23 H -0.0304 -0.6995 1.6076 H 1 UNL1111111111 0.1434 24 H 0.6776 2.5192 -1.4554 H 1 UNL1111111111 0.1391 25 H 2.1033 3.2191 -0.5804 H 1 UNL1111111111 0.1585 26 H 4.3466 -1.1665 -0.8722 H 1 UNL1111111111 0.3378 27 H 4.0071 1.4042 0.5517 H 1 UNL1111111111 0.3185 28 H 2.0235 -3.3147 0.8827 H 1 UNL1111111111 0.3367 29 H -0.5170 3.0092 0.4791 H 1 UNL1111111111 0.3248 30 H -1.7402 0.6823 1.5516 H 1 UNL1111111111 0.1645 31 H -2.8037 -1.9248 -1.7239 H 1 UNL1111111111 0.1720 32 H -4.0365 1.6077 1.5560 H 1 UNL1111111111 0.1483 33 H -5.1114 -0.9656 -1.7172 H 1 UNL1111111111 0.1494 34 H -5.7137 0.7955 -0.0788 H 1 UNL1111111111 0.1533 @BOND 1 1 10 1 2 1 11 1 3 2 7 1 4 2 26 1 5 3 8 1 6 3 27 1 7 4 11 1 8 4 13 1 9 5 9 1 10 5 28 1 11 6 12 1 12 6 29 1 13 7 8 1 14 7 9 1 15 7 19 1 16 8 10 1 17 8 20 1 18 9 11 1 19 9 21 1 20 10 12 1 21 10 22 1 22 11 23 1 23 12 24 1 24 12 25 1 25 13 14 ar 26 13 15 ar 27 14 16 ar 28 14 30 1 29 15 17 ar 30 15 31 1 31 16 18 ar 32 16 32 1 33 17 18 ar 34 17 33 1 35 18 34 1