MMs03921931 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 68 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 -1.5000 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2579 -1.2852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5159 -2.5888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2739 -3.8832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -1.3128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7579 -1.2760 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1579 -0.2367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6321 -0.0571 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4806 0.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0615 -0.5118 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2206 -0.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0707 -2.0118 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7602 -3.1709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -2.4841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2897 -2.8860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6562 -2.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8751 -3.1417 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -10.7493 -1.9228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0940 -4.0159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4606 -3.3974 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.4606 -4.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7634 -1.9283 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.0740 -0.7692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2542 -1.7623 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -15.4542 -1.7623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8727 -3.1289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7642 -4.1394 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -14.9233 -4.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9302 -5.6302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.8216 -6.6407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4401 -8.0072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.9309 -7.8413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2338 -6.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6575 -5.8999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.3722 -9.1633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7783 -6.8967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4755 -8.3658 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.0518 -8.8381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7489 -10.3072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.2021 -6.4245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.9962 -0.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4962 -0.4495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.0898 0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7529 -0.8197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1167 0.3238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2696 0.3773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1368 1.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1598 1.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9573 2.2633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0936 1.0521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 -2.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8484 -0.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4316 -3.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9668 -3.8767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6463 -6.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4443 -5.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.0987 -7.2219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8661 -0.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1973 0.7243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0009 -4.3606 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 55 1 0 0 0 0 8 56 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 51 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 64 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 44 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 0 0 0 0 33 34 2 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 35 41 1 0 0 0 0 36 37 1 0 0 0 0 37 39 2 0 0 0 0 38 40 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 43 60 1 0 0 0 0 43 61 1 0 0 0 0 44 45 1 0 0 0 0 44 62 1 0 0 0 0 44 63 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 64 -1 M END