IBS-ZINC01254577 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 1.0120 -0.5400 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -0.1690 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -0.8080 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -2.3970 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.7490 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 -2.6180 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -4.0820 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -4.7340 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 -4.6950 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3680 -3.9290 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6200 -4.5360 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7550 -3.7640 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6600 -2.3830 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -1.7670 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 -2.5300 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 -1.9220 0.1540 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9980 -0.5120 0.2740 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.3130 -6.1040 -0.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -6.7900 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -8.2750 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -9.0280 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -10.3920 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5680 -11.0020 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 -10.2520 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 -8.8880 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7450 -8.1560 0.9670 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -8.4310 0.6930 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 0.0580 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.5700 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -0.5160 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 0.6980 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -0.4440 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -3.2630 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -2.1080 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7010 -5.6090 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7260 -4.2370 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5590 -1.7910 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3820 -0.6920 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -6.5680 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -6.4640 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -10.9790 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -12.0660 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6830 -10.7300 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 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 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 19 1 M CHG 1 20 -1 M END