MMs00236809 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 67 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 1.3092 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5978 0.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9276 -2.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -2.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3298 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0411 -2.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3604 -2.6403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2254 -1.4148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3271 -0.2134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6823 0.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7252 -1.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 -0.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9572 -0.0644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7249 -1.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9928 -2.6623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 -2.6828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2248 -1.3325 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9569 -0.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4568 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2245 -1.2914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1889 1.3065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6887 1.3270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4209 2.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9207 2.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6885 1.3682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9564 0.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4565 0.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1883 1.3887 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 21.2089 -0.1111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1678 2.8886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6882 1.4093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.5531 2.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9859 2.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 0.6910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5864 0.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5857 1.0474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0474 0.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5857 -1.0474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5814 1.2355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6554 -4.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5731 -1.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9898 -3.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6553 -4.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8431 0.9459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5429 0.9829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9073 -3.7302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8238 0.3716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1491 1.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5747 2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8067 3.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5064 3.7042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5705 -0.9719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8708 -1.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.5058 3.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0261 3.7377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.2193 3.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.1810 2.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.1981 0.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.2721 -0.4792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.5555 -0.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0895 -0.8815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 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 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 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 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 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 M END