BB90UF -OEChem-04012118352D 77 80 0 1 0 0 0 0 0999 V2000 15.0583 -2.1949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4603 -1.6949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 -2.1949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.1949 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.7672 1.6370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 -0.6949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -0.1949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.1949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.1949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.6949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.1949 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.3263 0.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 -0.1949 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1923 1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2954 2.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2739 2.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1001 0.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4603 -0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6275 3.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5845 3.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7613 1.5290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -3.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9382 3.9887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 -1.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9167 4.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -4.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0583 -3.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0583 -3.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.2295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1142 1.3877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7157 0.6975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8632 0.1151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2280 0.2933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2607 0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4637 0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3297 -1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1267 -1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 -1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3947 -1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7292 -0.3849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 0.4251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5287 0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7316 0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0209 2.9103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1912 3.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6944 0.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3777 1.4621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8283 2.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 -1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6626 -1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5241 4.4501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1093 4.7842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4383 -4.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -4.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6783 -4.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0583 -3.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6783 -3.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0583 -2.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0583 -2.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4383 -3.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0583 -3.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.4251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.4597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.8495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.3620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.0278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 29 1 0 0 0 0 2 18 2 0 0 0 0 3 29 2 0 0 0 0 4 11 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 5 25 1 0 0 0 0 13 6 1 6 0 0 0 6 29 1 0 0 0 0 6 51 1 0 0 0 0 7 18 1 0 0 0 0 7 20 1 0 0 0 0 7 52 1 0 0 0 0 8 27 1 0 0 0 0 8 34 1 0 0 0 0 8 73 1 0 0 0 0 9 34 2 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 18 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 16 1 0 0 0 0 15 23 2 0 0 0 0 16 24 2 0 0 0 0 17 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 27 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 28 1 0 0 0 0 23 55 1 0 0 0 0 24 30 1 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 26 31 1 0 0 0 0 26 32 1 0 0 0 0 26 33 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 30 2 0 0 0 0 28 62 1 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 38 2 0 0 0 0 37 39 1 0 0 0 0 37 74 1 0 0 0 0 38 40 1 0 0 0 0 38 75 1 0 0 0 0 39 40 2 0 0 0 0 39 76 1 0 0 0 0 40 77 1 0 0 0 0 M CHG 2 4 -1 11 1 M END $$$$