PUBCHEM-ZINC05442487 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -1.4290 -1.1560 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.7030 -2.7550 -1.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -0.5300 -2.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -0.0460 -3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -2.1140 -0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -3.1540 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -4.4440 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -5.5000 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -5.2710 -2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -3.9870 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -2.9290 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -6.4040 -3.8240 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6490 -7.5360 -3.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -6.2040 -4.7680 O 0 5 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 0.5360 -4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 0.5850 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.8890 -3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -4.6230 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -6.5040 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -3.8110 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -1.9260 -2.7150 H 0 0 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 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END