D0W3WW -OEChem-10101305032D 93 97 0 1 0 0 0 0 0999 V2000 3.7320 1.3539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -2.1705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0379 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3074 -2.2753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4299 -3.7686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1893 -0.7006 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 2.3192 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 2.8539 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 2.3539 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3981 2.8331 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4804 1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3406 0.8093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.8539 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3291 -0.1906 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 4.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 4.3886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 2.3298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4573 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4458 -1.6805 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3060 -2.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1777 -1.7005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 -0.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1461 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9212 -0.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8312 -0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9132 -1.7622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7210 -0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8152 -2.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7133 -1.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5754 -2.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5908 -0.2620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4453 -1.7686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4530 -0.7687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5677 -3.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1773 -1.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 2.0165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5915 2.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9356 3.1420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8712 1.4340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2617 0.7392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 2.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 2.2713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9499 0.6946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5594 1.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.4739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8696 0.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.9739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 4.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 5.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 1.7940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7979 2.0177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5742 2.8655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8455 -0.7812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.8908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.6639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4386 -2.3005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -2.6608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -2.6700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4650 0.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 0.2689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5668 -2.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -0.7538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -1.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -0.1092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8432 0.4061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3750 -2.0702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -1.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8176 -2.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5956 0.3580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9923 -0.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9580 -3.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3512 -3.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4251 -4.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4831 -2.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7166 -1.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8714 -1.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10 1 1 1 0 0 0 1 28 1 0 0 0 0 24 2 1 6 0 0 0 2 74 1 0 0 0 0 3 26 2 0 0 0 0 4 28 2 0 0 0 0 5 41 1 0 0 0 0 5 44 1 0 0 0 0 6 43 1 0 0 0 0 6 90 1 0 0 0 0 7 17 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 6 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 46 1 6 0 0 0 10 14 1 0 0 0 0 10 47 1 0 0 0 0 11 19 1 0 0 0 0 11 21 1 6 0 0 0 11 48 1 0 0 0 0 12 15 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 18 2 0 0 0 0 13 20 1 0 0 0 0 14 16 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 17 15 1 6 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 1 0 0 0 16 55 1 0 0 0 0 17 22 1 0 0 0 0 17 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 2 0 0 0 0 19 58 1 0 0 0 0 20 59 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 22 24 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 27 30 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 29 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 1 0 0 0 29 73 1 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 31 36 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 33 35 1 0 0 0 0 33 80 1 0 0 0 0 34 37 2 0 0 0 0 34 81 1 0 0 0 0 35 38 2 0 0 0 0 35 40 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 37 38 1 0 0 0 0 37 85 1 0 0 0 0 38 39 1 0 0 0 0 39 41 2 0 0 0 0 39 43 1 0 0 0 0 40 42 2 0 0 0 0 40 86 1 0 0 0 0 41 42 1 0 0 0 0 42 87 1 0 0 0 0 43 88 1 0 0 0 0 43 89 1 0 0 0 0 44 91 1 0 0 0 0 44 92 1 0 0 0 0 44 93 1 0 0 0 0 M END $$$$