IFLAB-ZINC04315302 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 1.4650 -0.9010 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -0.0820 -0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.6810 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 0.1650 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -0.3130 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -1.6520 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -2.4990 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -2.0190 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -2.2200 0.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0430 -1.5710 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -0.3920 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2520 -2.4670 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -1.1300 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6710 -0.1680 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0010 -0.8040 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9560 -1.3430 0.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.8300 -0.4970 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7680 -2.2970 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2240 -2.0540 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3630 -1.4000 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4740 -0.4010 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3290 -2.3410 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6530 -2.2400 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3570 -3.4410 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7580 -4.6740 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4290 -4.7480 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7080 -3.5540 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4090 -3.3570 0.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -0.2750 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -1.2990 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -1.7070 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 1.2120 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 0.3920 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -3.5490 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.7170 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -3.2080 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4530 -3.0380 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 -3.1440 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -0.6280 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6010 -2.0100 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7160 0.1530 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5050 0.7340 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2370 -1.6150 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8030 -0.0620 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8510 -3.2020 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6680 -2.5870 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1220 -1.2850 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3920 -3.4130 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3320 -5.5900 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9630 -5.7030 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4850 -1.6130 0.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.3470 -0.7740 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 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 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END