IBS-ZINC02412900 MOE2007 3D Structure written by MMmdl. 61 63 0 0 0 0 0 0 0 0999 V2000 10.7450 6.0960 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0700 4.7650 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 4.0350 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0080 2.7040 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8080 1.2390 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6670 1.1580 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8490 0.4110 -2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7280 0.3280 -4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 1.1060 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 1.9380 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 1.0490 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 1.8590 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 1.2550 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 1.9780 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 1.3330 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 2.3160 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 2.2690 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 3.4580 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 4.6820 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 4.7540 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 3.5540 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 3.3210 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 4.0470 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 3.4170 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.0080 0.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -0.6330 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -0.0900 0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0070 6.6000 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6630 5.9530 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 6.7570 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1730 4.9410 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 4.1410 2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5900 3.8790 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0140 4.6660 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 2.8820 1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6470 2.0230 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 1.7810 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8390 0.2520 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7360 0.6520 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 2.1710 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7870 0.9180 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9040 -0.6030 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7020 1.3260 -4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5830 -0.2110 -4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8160 -0.2030 -4.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 0.5830 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 0.3650 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 2.4770 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 2.6990 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 0.5160 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 0.3050 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 2.8600 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 1.3100 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 5.6070 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 5.7120 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 3.5070 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 4.2330 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 2.4790 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -1.7130 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 2.0000 -0.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 8.3700 2.7320 -0.8030 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 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 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 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 60 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 9 60 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 27 2 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END