PUBCHEM-ZINC05901780 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 0.8670 -0.4030 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -0.2580 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.8250 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -0.8790 0.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7720 -0.7400 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -2.9910 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -4.4970 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -5.1690 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -6.5530 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -7.2770 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -6.6190 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -5.2340 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -0.0760 1.3520 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -0.4580 0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 1.6750 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 2.6230 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 2.9410 2.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -0.3760 2.7670 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8660 0.0390 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 0.1190 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.4510 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.8140 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -1.8730 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.7510 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -0.2600 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -2.6910 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -2.7480 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -4.6030 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -7.0630 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -8.3550 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -7.1830 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -4.7290 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 1.9950 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 1.7810 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.3280 0.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -2.7810 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 3.0970 0.5220 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 35 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 37 -1 M END