PUBCHEM-ZINC05502680 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.1020 1.4970 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.0630 -0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.5100 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -1.7150 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -1.8460 3.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -0.8020 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 0.0350 2.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 1.2340 2.3310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9800 2.0270 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 1.1600 1.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2140 2.1710 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 1.0330 3.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8060 1.3760 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 1.8790 4.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1480 2.9450 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 1.6910 3.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 1.5320 5.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 2.4200 6.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 2.4160 5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -0.3440 3.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -0.7620 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 0.0980 1.0700 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2750 -2.7120 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -3.3970 1.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -2.8750 -0.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.2390 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -0.7550 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -0.3220 -2.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.8740 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.7360 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 1.9960 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -0.6070 4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 0.5150 5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 1.6440 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -3.5120 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.3990 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.7080 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 35 1 0 0 0 0 26 27 1 0 0 0 0 26 36 1 0 0 0 0 26 37 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 22 -1 M END