@MOLECULE (3r,11as)-3,8-dihydroxy-7-methoxy-1,2,3,11a-tetrahydro-5h-pyrrolo[2,1-c][1,4]benzodiazepin-5-one 33 35 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.4240 2.0443 0.7191 O.3 1 UNL111111111 -0.5582 2 O -0.8983 1.8251 -1.2815 O.2 1 UNL111111111 -0.4901 3 O 3.9280 1.0886 0.5175 O.3 1 UNL111111111 -0.3371 4 O 4.1459 -1.5971 0.3718 O.3 1 UNL111111111 -0.4395 5 N -1.9865 0.3364 -0.0012 N.am 1 UNL111111111 -0.5874 6 N -0.3992 -2.1518 -0.7620 N.2 1 UNL111111111 -0.3490 7 C -2.1083 -0.9893 0.6236 C.3 1 UNL111111111 0.0333 8 C -3.6108 -1.1561 0.9474 C.3 1 UNL111111111 -0.2907 9 C -3.2877 0.9928 -0.1929 C.3 1 UNL111111111 0.3628 10 C -4.3369 -0.1059 0.0952 C.3 1 UNL111111111 -0.3458 11 C -0.8293 0.8232 -0.6013 C.2 1 UNL111111111 0.6054 12 C -1.6045 -2.0535 -0.3434 C.2 1 UNL111111111 0.0543 13 C 0.4539 0.1330 -0.3258 C.ar 1 UNL111111111 -0.2065 14 C 0.6219 -1.2558 -0.3883 C.ar 1 UNL111111111 0.1729 15 C 1.5479 0.9681 -0.0550 C.ar 1 UNL111111111 -0.1446 16 C 1.8859 -1.8270 -0.1555 C.ar 1 UNL111111111 -0.2340 17 C 2.7899 0.4109 0.1857 C.ar 1 UNL111111111 0.0764 18 C 2.9565 -0.9957 0.1377 C.ar 1 UNL111111111 0.2459 19 C 3.9555 2.4662 0.1615 C.3 1 UNL111111111 -0.1857 20 H -1.4905 -1.0198 1.5608 H 1 UNL111111111 0.1599 21 H -3.7957 -0.9856 2.0231 H 1 UNL111111111 0.1516 22 H -3.9721 -2.1756 0.7394 H 1 UNL111111111 0.1518 23 H -3.3739 1.5052 -1.1811 H 1 UNL111111111 0.1712 24 H -4.7141 -0.5374 -0.8464 H 1 UNL111111111 0.1566 25 H -5.2115 0.3223 0.6145 H 1 UNL111111111 0.1694 26 H -2.3378 -2.7859 -0.7074 H 1 UNL111111111 0.1742 27 H -3.1237 1.8052 1.6176 H 1 UNL111111111 0.3253 28 H 1.3968 2.0506 -0.0453 H 1 UNL111111111 0.1880 29 H 2.0242 -2.9077 -0.2172 H 1 UNL111111111 0.1999 30 H 4.8627 -0.9245 0.5263 H 1 UNL111111111 0.3409 31 H 4.9992 2.7383 0.3663 H 1 UNL111111111 0.1479 32 H 3.2768 3.0369 0.8043 H 1 UNL111111111 0.1384 33 H 3.7191 2.6093 -0.8982 H 1 UNL111111111 0.1427 @BOND 1 1 9 1 2 1 27 1 3 2 11 2 4 3 17 1 5 3 19 1 6 4 18 1 7 4 30 1 8 5 7 1 9 5 9 1 10 5 11 am 11 6 12 2 12 6 14 1 13 7 8 1 14 7 12 1 15 7 20 1 16 8 10 1 17 8 21 1 18 8 22 1 19 9 10 1 20 9 23 1 21 10 24 1 22 10 25 1 23 11 13 1 24 12 26 1 25 13 14 ar 26 13 15 ar 27 14 16 ar 28 15 17 ar 29 15 28 1 30 16 18 ar 31 16 29 1 32 17 18 ar 33 19 31 1 34 19 32 1 35 19 33 1