BD30QK -OEChem-04022115223D 37 40 0 1 0 0 0 0 0999 V2000 -2.7657 -3.3225 -0.2142 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1738 0.8520 -0.0622 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3734 -2.2473 0.4163 N 0 0 1 0 0 0 0 0 0 0 0 0 -2.2752 -0.9414 0.9974 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0686 3.8846 -0.5096 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2012 -0.8726 -0.0917 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0930 -0.0757 0.8775 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7617 -2.3100 0.9123 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1793 -3.2917 -0.5971 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -3.4618 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2423 -0.4097 -0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4353 1.3150 0.3904 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6573 0.5941 -0.9589 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1554 -0.9871 0.7986 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1322 2.4234 1.1735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0546 1.4900 -0.8422 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9854 1.0201 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4835 -0.5611 0.8056 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4664 3.6752 0.6826 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3475 2.7836 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8985 0.4426 -0.0697 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5788 -0.8113 -1.1216 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6116 -0.0100 1.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7654 -2.7778 1.9026 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7488 -0.7834 1.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -3.0917 -1.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0444 -4.2330 -0.0771 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4718 -4.4328 -1.9313 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5484 -2.6712 -2.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9598 1.0493 -1.6564 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8647 -1.7587 1.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6489 2.3260 2.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3185 0.6555 -1.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3091 1.8007 -1.6341 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1942 -1.0075 1.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2511 4.5717 1.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8324 2.9738 -2.1948 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 21 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 25 1 0 0 0 0 5 19 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 22 1 0 0 0 0 7 12 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 18 2 0 0 0 0 14 31 1 0 0 0 0 15 19 1 0 0 0 0 15 32 1 0 0 0 0 16 20 2 0 0 0 0 16 33 1 0 0 0 0 17 21 2 0 0 0 0 17 34 1 0 0 0 0 18 21 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 M END $$$$