IBS-ZINC02218110 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.1610 2.0210 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 0.5050 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -0.1640 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -1.7000 -1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0740 -2.0160 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -2.3170 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -2.7200 -3.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -2.3280 -2.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -2.8420 -3.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0580 -3.8240 -3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -1.8980 -4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 -2.9840 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -2.4400 -2.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -2.2720 -1.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -3.4590 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -4.0690 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -3.9870 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -5.1960 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -5.6610 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -4.9180 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -3.7110 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -3.2340 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -2.0240 -1.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -1.6060 -1.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 2.3440 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 2.3990 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 2.4790 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 0.1630 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 0.2240 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 0.1960 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 0.1550 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -1.9950 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -2.2830 -5.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -1.7600 -5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -0.9090 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -5.7740 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -6.6010 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -5.2770 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -3.1390 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 -3.6190 -3.8680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 40 -1 M END