MMs02298179 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 1.4470 -0.3952 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5985 -1.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9778 -1.7981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4761 -1.7268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8713 -0.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2743 0.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4354 -0.6986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8384 -0.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0801 1.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 2.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 1.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4831 1.8435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6442 0.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0472 1.4247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2083 0.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9666 -1.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5636 -1.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4025 -0.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1277 -1.9548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5307 -1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6919 -2.3735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0948 -1.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3366 -0.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1754 0.5872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7724 0.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7395 0.1685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1638 0.2839 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 23.0123 1.1324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6330 1.6868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1347 1.6155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.6108 -0.1113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3161 1.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1576 0.3161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3161 -1.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8172 -2.1031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1599 -2.9842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2268 -2.6630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 -1.8829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7673 -0.9274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1124 3.4465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5871 2.4911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9548 2.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4341 2.4563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9566 2.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7951 1.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3411 0.0790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6560 -2.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1767 -2.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 -2.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2697 -0.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8157 -1.6332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4984 -3.5579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0237 -2.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 1.7715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8435 0.8161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.7936 1.9918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4510 2.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3840 2.5517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2947 -1.2689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.7684 -0.4275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.9270 1.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6172 0.5432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.9936 -0.6545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 63 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 63 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 27 31 1 0 0 0 0 27 64 2 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 32 1 0 0 0 0 28 64 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 M END