MMs00190651 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -0.6641 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1686 -2.5926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -1.4423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9621 -2.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4157 -2.3405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5695 -3.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -0.8436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1195 -0.2885 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9604 0.0221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7495 1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8234 2.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4534 3.6660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0095 4.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9356 3.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3056 1.5715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5083 3.4316 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5822 2.3843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8782 4.8852 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.7812 -0.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7215 1.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9897 2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3175 1.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3772 0.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1091 -0.7402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5857 2.3607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -4.1040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5313 1.0760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 0.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 2.0498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3126 4.5038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7135 5.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4465 0.7337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1904 1.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9420 3.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4395 -0.4973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1568 -1.9393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6480 1.8026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1504 -5.0459 0.0000 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END