MMs01334569 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 1.4141 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6878 -1.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1019 -2.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2423 -1.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9685 -0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5545 0.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6564 -2.0014 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 -3.4155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1567 -0.5873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0705 -2.5017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3442 -3.9766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2108 -1.5273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6249 -2.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7653 -1.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4915 0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0774 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9371 -0.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6319 1.3961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0460 0.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1863 1.8702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9126 3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6004 1.3699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8742 -0.1049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2883 -0.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4286 0.3692 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1549 1.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7408 2.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8427 -0.1312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1164 -1.6060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.5305 -2.1063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6709 -1.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3972 0.3429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9831 0.8433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4003 1.1313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1313 0.4003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4003 -1.1313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7755 -2.7547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3209 -3.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8808 0.7533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3355 1.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1643 -4.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5632 -5.1564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 -3.7576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8439 -3.2075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8965 -1.4534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8585 2.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8058 0.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4553 -0.1488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9721 0.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6742 -0.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6764 -1.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6976 -1.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2144 -1.3683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3548 1.8548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3526 3.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8146 3.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3314 3.3889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7495 -3.2862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.8022 -1.5322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.3094 1.1225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 32 33 2 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 M END