@MOLECULE (3s,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 -3.4666 1.3711 -1.1577 O.3 1 UNL111111111 -0.5870 2 O -0.8955 2.0920 -0.6397 O.2 1 UNL111111111 -0.5537 3 O 4.0200 0.9249 0.5341 O.3 1 UNL111111111 -0.3381 4 O 4.1145 -1.7009 -0.0585 O.3 1 UNL111111111 -0.4389 5 N -1.9604 0.4254 0.4073 N.am 1 UNL111111111 -0.5593 6 N -0.5246 -1.9391 -0.8779 N.2 1 UNL111111111 -0.3552 7 C -2.0958 -0.9857 0.7950 C.3 1 UNL111111111 0.0299 8 C -3.5761 -1.1553 1.2009 C.3 1 UNL111111111 -0.2864 9 C -3.2756 1.0745 0.1967 C.3 1 UNL111111111 0.3606 10 C -4.3360 0.0175 0.5624 C.3 1 UNL111111111 -0.3135 11 C -0.8229 0.9667 -0.1712 C.2 1 UNL111111111 0.6148 12 C -1.6986 -1.8814 -0.3707 C.2 1 UNL111111111 0.0626 13 C 0.4490 0.2132 -0.1232 C.ar 1 UNL111111111 -0.2146 14 C 0.5539 -1.1495 -0.4338 C.ar 1 UNL111111111 0.1828 15 C 1.5959 0.9632 0.1776 C.ar 1 UNL111111111 -0.1350 16 C 1.8087 -1.7853 -0.4097 C.ar 1 UNL111111111 -0.2376 17 C 2.8293 0.3412 0.2052 C.ar 1 UNL111111111 0.0692 18 C 2.9331 -1.0424 -0.0837 C.ar 1 UNL111111111 0.2523 19 C 4.0894 2.3334 0.3443 C.3 1 UNL111111111 -0.1860 20 H -1.4175 -1.1889 1.6679 H 1 UNL111111111 0.1635 21 H -3.6761 -1.1321 2.3013 H 1 UNL111111111 0.1529 22 H -3.9845 -2.1270 0.8795 H 1 UNL111111111 0.1518 23 H -3.3183 2.0197 0.7883 H 1 UNL111111111 0.1366 24 H -4.8709 -0.2973 -0.3572 H 1 UNL111111111 0.1775 25 H -5.1010 0.4313 1.2366 H 1 UNL111111111 0.1542 26 H -2.4830 -2.5129 -0.8095 H 1 UNL111111111 0.1776 27 H -2.7599 1.9822 -1.4844 H 1 UNL111111111 0.3617 28 H 1.4918 2.0328 0.3774 H 1 UNL111111111 0.1871 29 H 1.8967 -2.8436 -0.6612 H 1 UNL111111111 0.2012 30 H 4.8672 -1.0776 0.1320 H 1 UNL111111111 0.3415 31 H 5.1592 2.5356 0.4844 H 1 UNL111111111 0.1481 32 H 3.4981 2.8459 1.1103 H 1 UNL111111111 0.1369 33 H 3.7701 2.6179 -0.6638 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