MMs02879695 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 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 -1.2927 -0.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -2.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0253 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3053 -0.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -4.4998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3434 -5.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -4.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9413 -5.2169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -6.7168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6614 -7.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -6.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2546 -5.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -6.7607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -4.5218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8526 -5.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8399 -6.7827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1326 -7.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4379 -6.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4506 -5.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1579 -4.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1706 -3.0438 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.4759 -2.3048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -2.2828 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.7306 -7.5656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7179 -9.0655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0101 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3369 -0.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3141 -2.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3623 -2.8301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3395 -0.1302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6259 -3.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9755 -4.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9983 -7.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6715 -8.6777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3219 -7.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7957 -7.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1225 -8.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4949 -4.7135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0359 -6.8266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0700 -7.4354 0.0000 H 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END