D01IDD -OEChem-10101305022D 42 45 0 0 0 0 0 0 0999 V2000 6.3758 0.4371 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7000 3.8312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3257 -0.0883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.2419 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7094 -1.1461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0405 1.0729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5763 -0.6476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.6324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.6819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3701 0.3309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6887 1.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0183 0.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6665 1.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3813 2.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0295 3.0892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3369 2.1376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0518 3.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6777 3.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -0.0623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -2.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -3.8312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.2472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8499 1.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8571 0.8057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7751 2.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9431 2.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8612 3.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5478 3.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2840 3.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8077 4.2278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 18 1 0 0 0 0 2 23 1 0 0 0 0 2 26 1 0 0 0 0 3 20 2 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 4 30 1 0 0 0 0 5 7 1 0 0 0 0 5 15 2 0 0 0 0 6 18 1 0 0 0 0 6 20 1 0 0 0 0 6 35 1 0 0 0 0 7 18 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 14 2 0 0 0 0 11 15 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 16 1 0 0 0 0 13 31 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 24 1 0 0 0 0 21 36 1 0 0 0 0 22 25 2 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$