D04KGP -OEChem-10101305022D 42 45 0 1 0 0 0 0 0999 V2000 2.9176 2.5016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3903 -0.5299 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.5321 -0.0330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5321 0.9670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2558 -0.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4421 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2814 0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3829 -1.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.9670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4501 2.5154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 2.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2452 -2.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 3.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.5017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2378 -3.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5315 -0.8830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 -1.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 -1.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4575 -0.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8685 0.0486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8885 0.8197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5131 1.5207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7731 -1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1665 -2.1109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9882 2.8234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1095 2.8123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -2.1485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4615 -1.4553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5456 3.6563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6178 -3.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2332 -3.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8578 -3.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 2.8178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 22 1 1 0 0 0 4 7 1 0 0 0 0 4 9 2 0 0 0 0 5 10 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 12 2 0 0 0 0 10 16 1 0 0 0 0 11 15 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 18 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 14 17 2 0 0 0 0 14 32 1 0 0 0 0 15 21 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 19 2 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M END $$$$