PUBCHEM-ZINC05643881 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -2.5530 1.6920 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 0.5420 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 0.0430 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.5140 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -1.8620 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -2.5990 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -3.9750 0.8060 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7810 -4.4160 2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -3.7090 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -4.4810 4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -5.8890 4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -6.6000 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -5.8280 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -6.1470 0.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -5.0730 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -5.3840 -1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -4.7380 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -6.7880 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -7.2390 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -7.5680 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -8.7580 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -9.4980 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -9.0690 -4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -7.8820 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -7.1370 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -9.8880 -5.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -9.5030 -7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 2.3730 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 2.2720 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 1.3270 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 0.8780 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 0.0060 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.2620 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 1.1360 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -0.1310 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.6060 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.2140 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -1.7820 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.4230 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -2.0830 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -2.6270 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -2.6300 3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -3.9810 5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -6.4390 5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -7.6810 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -8.2490 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -9.1320 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -10.4210 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -7.5100 -5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -6.2290 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -10.2600 -7.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -9.4720 -7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -8.5440 -7.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -0.4440 -0.0240 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.4480 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 54 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 7 1 M CHG 1 54 1 M END