B3FMW2 -OEChem-04042104253D 69 71 0 0 0 0 0 0 0999 V2000 -5.9203 1.4851 -0.4637 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1602 3.2363 0.8743 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9298 0.0448 -0.3994 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3488 1.5501 -1.8436 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0622 2.6122 0.4314 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0089 1.0423 1.5577 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5561 -1.7880 -0.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9081 -0.6209 -0.0802 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2955 0.9460 -0.4167 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5945 0.3843 -0.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4617 -0.8298 -0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1144 -1.9430 -1.1434 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -1.2077 1.2714 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5519 -3.3362 -0.6872 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3772 -2.6024 1.7262 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1712 0.4956 -0.5796 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0101 -3.6691 0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4356 -0.3238 -1.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2409 0.4616 0.8566 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9519 -0.1398 -1.3783 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7533 0.6613 0.9423 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7058 0.0837 0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4171 0.6707 0.4605 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2097 0.2788 0.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8795 0.5308 0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8825 -0.9116 1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7452 1.6131 0.3971 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -0.7155 -0.1342 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1134 1.4489 0.1811 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7501 -0.8798 -0.3503 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6158 0.2025 -0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6851 4.2397 -0.5422 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 -3.0202 -0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4441 -1.7496 -2.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9783 -1.9986 -1.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1492 -1.2922 1.2413 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1379 -0.4716 2.0543 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1956 -4.0842 -1.4048 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6464 -3.3999 -0.6817 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4595 -2.6148 1.9014 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.8413 2.6838 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0197 1.3401 0.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1017 0.7928 -1.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0814 -3.7662 0.6503 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -4.6408 1.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2835 -1.1454 -2.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0266 0.5895 -1.8612 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8427 1.4381 0.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9284 0.2492 1.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4308 -1.0795 -1.0826 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2975 0.1250 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2035 -0.2463 1.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9659 1.4992 1.6145 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0224 0.0993 -1.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3072 -0.0406 1.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4877 -0.8041 -0.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4368 1.1850 0.9613 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6367 0.4238 -0.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7057 -1.8296 0.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5056 -1.0599 2.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9636 -0.7517 1.1091 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8121 2.2723 0.3056 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2147 -1.8151 -0.6417 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 5.2520 -0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2989 3.8159 -1.4732 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7751 4.3010 -0.5945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3604 -3.7605 -0.7623 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -3.3874 0.0888 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6317 -2.9504 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 9 1 0 0 0 0 1 22 1 0 0 0 0 2 27 1 0 0 0 0 2 32 1 0 0 0 0 3 31 1 0 0 0 0 6 23 2 0 0 0 0 7 28 1 0 0 0 0 7 33 1 0 0 0 0 8 11 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 16 1 0 0 0 0 10 23 1 0 0 0 0 10 54 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 17 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 20 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 21 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 24 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 27 1 0 0 0 0 25 28 2 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 M END $$$$