MMs00040518 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7455 -1.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2455 -1.3068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7545 1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0089 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4911 2.6032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2366 3.9048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4821 5.2013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7366 3.9100 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4260 5.0691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9737 3.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6386 5.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4591 6.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0448 4.5822 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4448 5.6214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3510 3.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4711 2.9223 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1605 1.7632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7924 2.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0680 3.0015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4562 2.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4255 3.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6362 4.8538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1792 4.4974 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.9214 3.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7656 4.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2615 4.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4661 -0.3272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6178 -1.8195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2454 -2.4249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 2.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1954 3.7805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0946 1.5660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2255 2.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7396 2.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1411 6.5696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7696 5.0791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9644 7.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 6.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2564 2.7517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4367 2.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0494 1.2699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5914 1.3169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7414 1.2678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6259 2.3039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0154 2.9741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6716 5.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0611 5.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9369 5.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7924 -1.5741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9847 -2.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2526 3.9620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 57 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 14 57 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 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 57 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M END