D0P5IH -OEChem-10101305022D 82 87 0 1 0 0 0 0 0999 V2000 7.9924 2.8373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7931 3.7072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0829 -1.3548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5704 -0.0268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5759 2.7781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3185 3.0985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3276 2.1325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6346 0.3182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7028 -0.1994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.0442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4525 3.5985 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6617 4.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6504 4.6733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0555 3.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3185 2.0985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5865 3.0985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3418 1.0253 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4616 1.6325 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2358 0.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4099 -0.9065 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3758 -0.6477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4957 1.8914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9616 0.7665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1511 -1.8724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 1.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1852 -2.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2369 2.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8297 -3.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9648 0.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0118 2.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4132 -1.5050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8312 -3.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 3.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2709 3.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2822 -3.9514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7998 1.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8468 2.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7408 2.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2851 -3.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6852 4.5303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0121 4.0820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7361 -4.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7375 -4.7351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7192 4.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4699 2.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7655 4.0990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6626 5.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0452 4.6363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 4.8651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5217 5.2798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4210 3.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 4.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4408 0.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3807 2.2472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8195 1.7551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 0.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6616 0.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0977 0.6282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 1.8373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4416 1.2737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2051 -2.4901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7687 -1.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1039 -0.3599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0014 0.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4575 2.4036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4467 -0.8859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5428 3.4039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8325 2.6777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9013 -3.9849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3541 0.9519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8103 3.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -3.8098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0166 -5.3421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1236 4.9687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4132 4.2425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -5.2545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5588 5.3880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1921 1.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0242 2.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7477 2.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 16 2 0 0 0 0 3 21 2 0 0 0 0 4 23 2 0 0 0 0 5 38 1 0 0 0 0 5 45 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 16 1 0 0 0 0 7 18 1 0 0 0 0 7 55 1 0 0 0 0 8 17 1 0 0 0 0 8 21 1 0 0 0 0 8 58 1 0 0 0 0 9 20 1 0 0 0 0 9 23 1 0 0 0 0 9 64 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 68 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 46 1 6 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 17 1 0 0 0 0 17 19 1 6 0 0 0 17 53 1 0 0 0 0 18 22 1 6 0 0 0 18 23 1 0 0 0 0 18 54 1 0 0 0 0 19 25 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 1 0 0 0 20 59 1 0 0 0 0 22 27 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 24 26 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 28 1 0 0 0 0 26 31 2 0 0 0 0 27 33 2 0 0 0 0 27 34 1 0 0 0 0 28 32 1 0 0 0 0 28 35 2 0 0 0 0 29 36 1 0 0 0 0 29 65 1 0 0 0 0 30 37 2 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 32 39 2 0 0 0 0 33 40 1 0 0 0 0 33 69 1 0 0 0 0 34 41 2 0 0 0 0 34 70 1 0 0 0 0 35 42 1 0 0 0 0 35 71 1 0 0 0 0 36 38 2 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 37 73 1 0 0 0 0 39 43 1 0 0 0 0 39 74 1 0 0 0 0 40 44 2 0 0 0 0 40 76 1 0 0 0 0 41 44 1 0 0 0 0 41 77 1 0 0 0 0 42 43 2 0 0 0 0 42 75 1 0 0 0 0 43 78 1 0 0 0 0 44 79 1 0 0 0 0 45 80 1 0 0 0 0 45 81 1 0 0 0 0 45 82 1 0 0 0 0 M END $$$$