D0TH8E -OEChem-10101305022D 58 62 0 1 0 0 0 0 0999 V2000 3.7320 -3.4302 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9634 0.0248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.4302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -3.4302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.4302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.8741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8927 -0.9791 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.4217 -0.5036 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2454 -0.9791 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0690 -0.5036 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -0.9791 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9712 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 0.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 0.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3239 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9302 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2454 0.9231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2454 -1.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 -2.4057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2454 1.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5739 -1.7112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 2.3497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 4.7402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 3.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7918 -1.6302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3604 -1.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7816 -1.2155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 0.7986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4116 0.4607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6796 0.3399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2811 1.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 0.3777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2309 0.8069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7823 -2.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 -3.0257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7823 2.1841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1199 -2.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -2.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0278 -1.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 2.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -4.7402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.9111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.6842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 4.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 5.2771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 5.0502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 3.3181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 2.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 2.6981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 2 13 1 0 0 0 0 2 21 1 0 0 0 0 18 3 1 6 0 0 0 4 25 1 0 0 0 0 4 27 1 0 0 0 0 5 49 1 0 0 0 0 8 27 2 0 0 0 0 9 12 1 0 0 0 0 9 17 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 1 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 32 1 1 0 0 0 12 16 1 0 0 0 0 12 33 1 6 0 0 0 13 18 1 0 0 0 0 13 34 1 1 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 19 2 0 0 0 0 15 21 1 0 0 0 0 16 19 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 22 1 0 0 0 0 18 41 1 0 0 0 0 19 23 1 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 25 2 0 0 0 0 22 43 1 0 0 0 0 23 26 2 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$