D0T2FP -OEChem-04152113053D 40 42 0 1 0 0 0 0 0999 V2000 -6.6074 0.6041 0.2403 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0627 -1.7621 0.0828 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3753 -2.4659 -0.1576 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2134 1.0855 -0.9308 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2898 -0.3921 0.0668 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1042 1.0223 -2.2832 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6954 0.7755 0.0563 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3386 2.0617 -0.0405 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4546 1.0134 0.3260 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3858 -0.0853 0.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8591 2.4318 0.4884 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2762 0.7519 1.5685 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.2581 0.1911 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7661 -1.4225 0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0623 -0.7355 0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7944 -2.4162 -0.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4426 -2.0727 -0.0431 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5961 0.5684 1.6192 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4828 0.9363 -1.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3963 -1.2451 -0.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7218 -0.5723 -0.0464 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8839 -1.3194 -0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0971 -0.6399 -0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1107 0.7468 -0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8937 1.4015 0.0537 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3391 1.4719 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2332 2.5243 1.3844 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2654 2.7290 -0.3852 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6585 3.1796 0.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7326 0.7141 2.5123 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6953 1.2850 0.2769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0923 -3.4568 -0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.8984 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0674 0.3884 2.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4879 0.6028 0.1506 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5785 1.2095 -3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1071 0.9011 -2.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8762 -2.4010 -0.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0233 -1.2033 -0.2312 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8358 2.4830 0.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 14 1 0 0 0 0 3 20 2 0 0 0 0 4 9 1 0 0 0 0 4 19 2 0 0 0 0 5 15 1 0 0 0 0 5 20 1 0 0 0 0 5 35 1 0 0 0 0 6 19 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 21 2 0 0 0 0 7 25 1 0 0 0 0 8 26 3 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 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 18 2 0 0 0 0 12 30 1 0 0 0 0 13 15 2 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$