Ketcher 07021513532D 1 1.00000 0.00000 0 75 81 0 1 0 999 V2000 8.5040 -7.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0278 -0.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2180 -0.3992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7186 -1.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4079 -0.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7174 -1.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3069 -2.7498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8417 -5.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7429 -6.3922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9746 -6.3922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1076 -5.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2404 -6.3922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -4.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1076 -4.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -3.3886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -3.3886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 -2.8879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8761 -1.8867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5084 -0.5191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -1.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5096 -0.5191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 -1.8867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2748 -1.3861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7429 -1.3861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7453 -1.3861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7476 -1.3861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7441 -0.3850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7441 -2.3873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 -0.3850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 -2.3873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7441 -1.3861 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 -1.3861 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.4556 -0.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1287 -2.7498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1275 -3.7510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1298 -3.7510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1287 -3.7510 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.1287 -4.7522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9800 -0.6783 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7242 -1.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3871 0.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5911 -0.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7242 -2.3493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3830 0.1317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4584 -1.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5913 -2.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4584 -2.3492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.3252 -0.8475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6102 -5.8916 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4949 -6.4280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3174 -7.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3595 -5.9230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -9.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -10.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -11.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2812 -11.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2812 -8.5134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9675 -9.8239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5559 -9.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4141 -11.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4141 -10.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4141 -9.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 -8.5134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 -7.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1481 -8.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -11.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -11.5170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1481 -11.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1481 -10.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2812 -9.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 -9.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9675 -8.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1481 -9.0142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2812 -10.5157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 -10.5157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 39 1 1 0 0 3 2 1 0 0 0 4 2 1 0 0 0 5 3 1 0 0 0 6 4 1 0 0 0 4 7 1 6 0 0 5 33 1 1 0 0 6 5 1 0 0 0 6 34 1 6 0 0 10 8 1 0 0 0 8 9 1 0 0 0 9 49 1 0 0 0 11 10 1 0 0 0 14 11 1 0 0 0 11 12 2 0 0 0 13 15 1 0 0 0 14 13 1 0 0 0 17 15 1 0 0 0 17 16 2 0 0 0 17 22 1 0 0 0 20 18 1 0 0 0 18 24 1 0 0 0 20 19 1 0 0 0 22 20 1 0 0 0 20 21 1 0 0 0 22 23 1 6 0 0 24 31 1 0 0 0 31 25 1 0 0 0 25 32 1 0 0 0 32 26 1 0 0 0 33 26 1 0 0 0 31 27 2 0 0 0 31 28 1 0 0 0 32 29 2 0 0 0 32 30 1 0 0 0 34 37 1 0 0 0 37 35 1 0 0 0 37 36 1 0 0 0 37 38 2 0 0 0 40 39 1 0 0 0 41 39 1 0 0 0 42 40 2 0 0 0 43 40 1 0 0 0 44 41 2 0 0 0 45 42 1 0 0 0 44 42 1 0 0 0 46 43 2 0 0 0 47 45 2 0 0 0 48 45 1 0 0 0 47 46 1 0 0 0 1 51 1 4 0 0 50 1 1 0 0 0 50 52 2 0 0 0 49 50 1 0 0 0 53 54 1 0 0 0 61 53 1 0 0 0 54 66 1 0 0 0 66 55 1 0 0 0 55 60 2 0 0 0 70 61 1 0 0 0 61 60 1 0 0 0 60 56 1 0 0 0 56 68 1 0 0 0 69 68 1 0 0 0 71 69 1 0 0 0 69 70 1 0 0 0 70 57 1 0 0 0 65 57 1 0 0 0 63 65 1 0 0 0 71 58 1 0 0 0 71 63 1 0 0 0 63 72 1 0 0 0 72 59 1 0 0 0 58 59 1 0 0 0 61 62 1 1 0 0 63 64 1 1 0 0 66 67 2 0 0 0 69 73 1 1 0 0 70 74 1 6 0 0 71 75 1 6 0 0 72 1 2 0 0 0 M CHG 4 28 -1 30 -1 35 -1 36 -1 M END