PUBCHEM-ZINC01006312 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.4840 1.0700 -1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.3040 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -0.8490 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 0.0010 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 1.3850 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 1.9240 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 2.0170 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 3.3430 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 3.6830 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 2.7030 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 1.3660 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 1.0340 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -0.3370 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -1.3600 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -1.7880 1.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 -2.6850 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -3.1520 2.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 -2.9510 2.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6430 -3.8500 3.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5050 -3.3600 4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -5.2300 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -6.1690 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1270 -6.3040 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8100 -4.9410 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 -4.0200 3.2250 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2760 -4.4820 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8240 -2.6350 3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 -2.3890 3.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 1.4720 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.9490 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -1.9100 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 2.9830 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 4.1080 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 4.7190 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2160 2.9880 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 0.6140 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -0.6780 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -0.9320 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -2.2410 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 -2.3980 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 -5.1380 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -5.6830 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4660 -5.7890 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 -7.1570 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 -6.9210 5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 -6.8260 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 -4.4840 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8720 -5.0790 4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 -1.9080 2.1900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 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 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 49 -1 M END