PUBCHEM-ZINC05318467 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.6080 -1.3380 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -0.4290 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 0.5640 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.9850 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 2.1330 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 1.1360 0.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5120 1.3300 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 1.2610 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 0.9090 -1.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -0.2710 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -0.7890 -1.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -0.9220 -2.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8060 0.0680 -3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 0.6160 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 1.5610 -4.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 1.9900 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 1.4720 -5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 0.5180 -4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -0.0560 -5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -1.5060 -5.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -2.5300 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -2.2930 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -3.4260 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -4.6990 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -4.8270 -4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -3.7840 -4.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -1.1470 -1.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -1.0900 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -2.3130 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -1.3520 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -1.4530 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.2680 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 0.4640 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 0.3430 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 2.2390 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 2.6880 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 3.1560 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 2.0110 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 0.6560 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 2.3000 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 0.3320 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.9660 -4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 2.7240 -6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 1.8110 -6.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 0.0600 -4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 0.5080 -6.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -1.7980 -6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -1.5940 -6.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -3.3310 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -5.5600 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -5.7920 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -1.7520 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -0.2940 0.7950 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4440 -0.5320 -0.2100 H 0 0 0 0 0 0 0 0 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 1 53 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 2 53 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 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END