PUBCHEM-ZINC03864207 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0410 1.0270 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -0.4490 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -0.8140 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -0.0340 0.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -0.5380 0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 0.1950 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 1.4940 0.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -0.6540 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2060 -0.1940 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1560 -1.0910 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2870 -0.7480 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9410 -1.9390 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 -2.9640 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1230 -2.4350 -1.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5140 -4.4010 -2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6690 -5.3440 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9670 -6.6790 -1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1150 -7.1000 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9590 -6.1580 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6660 -4.8220 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4350 -8.5380 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7010 -9.3560 -1.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5410 -8.9430 -2.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7930 -10.3720 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -2.0210 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -2.6200 0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -2.5860 0.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -1.8720 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -2.4030 0.9910 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 1.2910 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.2020 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.6420 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -1.0640 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -0.6240 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 2.0010 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 0.8540 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6010 0.2490 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8590 -2.0400 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7820 -5.0190 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3150 -7.4070 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8460 -6.4830 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3210 -4.0940 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8950 -10.7560 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7120 -10.5620 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9600 -10.8720 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 M END