B6SKR3 -OEChem-04022106592D 61 65 0 0 0 0 0 0 0999 V2000 16.9147 2.7104 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8718 -3.8304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7185 -0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7185 2.7104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4147 3.5764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4147 1.8444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.3271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0487 3.2104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.3338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4967 -1.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 -2.8304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 -2.8237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7282 -1.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -2.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5923 -0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4602 -1.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3243 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1884 -0.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0525 0.1896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9586 -0.3243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0525 1.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8525 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8525 1.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9586 1.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7185 1.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5845 1.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4506 1.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5845 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4506 2.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3166 1.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1826 2.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3166 3.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1826 1.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7807 2.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4367 -1.8937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9701 -1.0693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0202 -1.0730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4166 -2.1278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8947 -2.9486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2033 -3.3002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0003 -3.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5139 -0.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 -1.4371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6784 -2.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0742 -2.2104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 -0.3473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1919 -0.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9983 -1.6283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9657 -0.9442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5168 1.5433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9657 2.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1215 -0.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9136 3.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3166 0.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3166 3.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7196 1.4004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0487 3.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4707 1.6735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3176 1.9004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0907 2.7473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 8 1 0 0 0 0 1 35 1 0 0 0 0 2 12 2 0 0 0 0 3 23 1 0 0 0 0 3 29 1 0 0 0 0 4 26 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 32 1 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 13 15 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 3 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 50 1 0 0 0 0 22 25 2 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 29 53 1 0 0 0 0 30 33 1 0 0 0 0 30 54 1 0 0 0 0 31 34 2 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END $$$$