PUBCHEM-ZINC05737911 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9620 -1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.7080 -1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -2.8430 -3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -3.6220 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -2.7760 -0.6760 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -4.0560 -1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -1.8790 -0.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -3.0500 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -4.2020 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -4.4240 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -3.4980 3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -2.3350 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -2.1180 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -1.3380 4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -0.1730 4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 0.4630 5.2300 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8960 1.6330 5.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 2.1000 6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 1.3500 7.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 0.1440 7.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -0.2840 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -1.4200 5.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -2.1410 6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 1.8450 9.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -3.6990 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.1740 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -1.8520 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -3.3770 -3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -4.6130 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -3.0880 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -3.7180 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -4.9300 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -5.3250 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -3.6730 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -1.2220 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 0.1900 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 2.2190 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 3.0470 6.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -0.4620 8.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 2.4440 9.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 0.9940 9.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 2.4560 9.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M CHG 1 19 1 M END