@MOLECULE coumarin, 7-methoxy-6-(3-methyl-2-butenyl)- 34 35 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.1035 -0.4103 0.3544 O.2 1 UNL111111111 -0.3683 2 O 1.0970 -2.5749 -0.2071 O.3 1 UNL111111111 -0.2953 3 O -5.0549 0.5184 0.6357 O.2 1 UNL111111111 -0.4176 4 C 0.9101 -0.3178 -0.6543 C.ar 1 UNL111111111 -0.1287 5 C 2.3694 -0.3285 -0.9918 C.3 1 UNL111111111 -0.2527 6 C -1.1929 0.8596 -0.3773 C.ar 1 UNL111111111 -0.2663 7 C 0.2610 -1.5128 -0.2343 C.ar 1 UNL111111111 0.3074 8 C 0.1752 0.8468 -0.7146 C.ar 1 UNL111111111 -0.0375 9 C -1.8002 -0.3400 0.0221 C.ar 1 UNL111111111 0.3531 10 C -1.0850 -1.5459 0.1021 C.ar 1 UNL111111111 -0.4008 11 C 3.1619 -0.0160 0.2387 C.2 1 UNL111111111 -0.2205 12 C 3.9258 1.0692 0.4138 C.2 1 UNL111111111 0.0515 13 C -1.9957 2.0464 -0.4177 C.ar 1 UNL111111111 0.0399 14 C -3.3035 1.9882 -0.0843 C.ar 1 UNL111111111 -0.3760 15 C 4.6777 1.2822 1.6888 C.3 1 UNL111111111 -0.4558 16 C 4.1132 2.1393 -0.6107 C.3 1 UNL111111111 -0.4537 17 C -3.9208 0.7420 0.3168 C.ar 1 UNL111111111 0.6028 18 C 0.5543 -3.8259 0.2010 C.3 1 UNL111111111 -0.2048 19 H 2.6801 -1.3225 -1.3891 H 1 UNL111111111 0.1641 20 H 2.5855 0.3781 -1.8197 H 1 UNL111111111 0.1496 21 H 0.6545 1.7792 -1.0200 H 1 UNL111111111 0.1580 22 H -1.5915 -2.4484 0.4198 H 1 UNL111111111 0.1930 23 H 3.0592 -0.7662 1.0227 H 1 UNL111111111 0.1535 24 H -1.5189 2.9814 -0.7230 H 1 UNL111111111 0.1565 25 H -3.9589 2.8573 -0.0954 H 1 UNL111111111 0.1904 26 H 4.6106 0.4242 2.3707 H 1 UNL111111111 0.1529 27 H 5.7452 1.4608 1.4987 H 1 UNL111111111 0.1535 28 H 4.2893 2.1554 2.2323 H 1 UNL111111111 0.1561 29 H 3.2018 2.3221 -1.1949 H 1 UNL111111111 0.1516 30 H 4.3997 3.0992 -0.1611 H 1 UNL111111111 0.1506 31 H 4.9088 1.8639 -1.3186 H 1 UNL111111111 0.1566 32 H 1.4261 -4.4899 0.1148 H 1 UNL111111111 0.1541 33 H -0.2445 -4.1453 -0.4766 H 1 UNL111111111 0.1410 34 H 0.2083 -3.7765 1.2382 H 1 UNL111111111 0.1418 @BOND 1 1 9 ar 2 1 17 ar 3 2 7 1 4 2 18 1 5 3 17 2 6 4 5 1 7 4 7 ar 8 4 8 ar 9 5 11 1 10 5 19 1 11 5 20 1 12 6 8 ar 13 6 9 ar 14 6 13 ar 15 7 10 ar 16 8 21 1 17 9 10 ar 18 10 22 1 19 11 12 2 20 11 23 1 21 12 15 1 22 12 16 1 23 13 14 ar 24 13 24 1 25 14 17 ar 26 14 25 1 27 15 26 1 28 15 27 1 29 15 28 1 30 16 29 1 31 16 30 1 32 16 31 1 33 18 32 1 34 18 33 1 35 18 34 1