D03ITI -OEChem-10101305032D 47 50 0 1 0 0 0 0 0999 V2000 10.9783 -2.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 0.8470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 0.2083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.8191 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.7083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.2083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1301 -0.8125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2241 0.7430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -1.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7741 -1.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9705 0.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4461 -0.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9495 0.3791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3236 1.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8671 -0.3889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6177 1.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8195 1.2128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8195 -1.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6177 -1.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 0.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3392 0.8129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 1.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 1.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -1.7666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -1.7666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5939 -1.7892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3909 -1.7923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -0.6840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -1.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8592 -0.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9491 -0.1264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5168 0.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7602 0.9695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 19 2 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 4 13 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 15 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 17 2 0 0 0 0 6 22 1 0 0 0 0 7 17 1 0 0 0 0 7 23 2 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 24 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 47 1 0 0 0 0 M END $$$$