BR90PF -OEChem-04022105173D 58 61 0 0 0 0 0 0 0999 V2000 -10.8332 -0.0233 -1.2349 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.9791 -1.8465 0.9911 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7368 0.6993 0.1417 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6650 1.5276 -0.8048 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4026 0.7292 0.7463 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6533 -1.4374 1.0667 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6781 -1.4061 -0.1189 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6227 -0.4299 -0.0121 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2655 0.4110 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7355 0.9130 1.5541 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1952 -0.4458 -0.4917 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3836 1.6130 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8629 0.3029 -0.5823 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1031 1.3936 0.6482 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 -0.3184 0.3388 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0129 0.3589 0.5146 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8321 0.0312 -0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3796 1.0321 0.4018 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6800 -0.9688 0.2226 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3476 1.0505 -1.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 0.0124 0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0355 -1.0412 -0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7097 1.0090 -1.3646 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5360 -0.0184 -0.8973 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8581 -0.0687 -0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0926 0.5546 -0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2146 -0.2461 -0.3073 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7916 -2.1520 -0.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0697 -1.6263 -0.3955 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5341 0.3569 -0.4057 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9914 0.0338 -0.0298 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4381 1.2939 -0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6265 0.0768 2.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4546 1.6082 2.0048 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -0.7194 -1.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0445 -1.3871 0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0314 1.8969 2.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5131 2.5389 0.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1442 -0.3771 -1.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9753 1.1653 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0966 1.9643 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0777 2.1145 -0.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8665 -0.2674 -0.3718 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0054 -0.3101 1.3846 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5786 1.6393 1.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3911 1.7300 -0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7195 1.8544 -1.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5044 -0.6712 1.0831 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3215 -0.5603 -0.6947 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6676 -1.8407 0.2815 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1301 1.7889 -1.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1683 1.6346 -0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6236 -3.2217 -0.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8997 -2.3026 -0.5658 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4664 -1.3488 0.3882 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6456 -0.8230 -0.2067 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1326 0.7822 -0.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2168 0.4752 0.9441 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 6 1 0 0 0 0 2 19 1 0 0 0 0 3 21 1 0 0 0 0 3 25 1 0 0 0 0 4 30 2 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 15 2 0 0 0 0 7 25 2 0 0 0 0 7 28 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 24 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$