PUBCHEM-ZINC06507589 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.4550 1.7240 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 0.2490 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -0.6710 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -2.0230 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.4600 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.5280 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.1780 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 0.8300 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -3.9110 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -4.4030 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -6.1550 -1.0650 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -6.0580 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -4.8180 0.9960 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1570 -4.4320 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -4.5950 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -4.0570 4.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -4.2130 4.2890 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0010 -5.2860 4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -5.0590 4.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -3.8170 4.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 -3.3720 4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -3.3270 4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -7.1400 1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -8.4420 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -8.7660 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -10.0700 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -11.0000 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -10.6610 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -9.4310 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 2.0580 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 2.2730 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 1.9080 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.3310 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -2.7400 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -1.8610 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 1.0530 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 0.4230 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.7450 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -3.8240 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -5.0700 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -3.3920 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 -4.0380 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -5.6500 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -4.6140 4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -3.0020 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -6.1760 5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -5.7270 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -2.3630 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -6.9930 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -8.0200 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -10.3580 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -12.0180 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -9.1900 2.6570 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 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 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 48 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 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 13 1 M CHG 1 17 1 M END