IFLAB-ZINC04139292 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 2.4330 0.6110 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -0.7990 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -1.8670 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -3.1760 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -3.4290 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -2.3670 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -1.0580 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -4.8280 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -5.6350 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -5.1630 -0.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -6.5070 -0.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1250 -7.1830 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -6.7130 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -6.8190 -2.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4250 -6.7440 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -5.7960 -3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -4.6810 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -3.9320 -4.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -4.4990 -4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -5.9280 -4.0780 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -9.3310 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -10.7280 -2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -10.9510 -3.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -10.0160 -4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -8.5870 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 1.0380 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 1.2340 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 0.6450 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -1.6850 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -3.9920 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.5250 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.2360 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -4.4790 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -5.9350 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -7.6890 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -6.6550 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -4.4080 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -3.0230 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -4.1410 -5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -9.1740 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -9.1890 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -11.4840 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -10.8800 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -10.2540 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -10.1400 -4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -8.4630 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -7.8770 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -8.2730 -2.6250 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8620 -8.3440 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 48 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END