B3NDS8 -OEChem-04022101082D 63 66 0 1 0 0 0 0 0999 V2000 2.0000 -0.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -0.1111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.4123 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 11.5865 -1.6077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3185 -1.6144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0467 -2.6210 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.4539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 1.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -0.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9904 -1.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -0.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8544 -1.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7224 -1.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4544 -1.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1865 -1.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0506 -1.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1903 -0.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9185 -1.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9224 -0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0089 1.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6071 2.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 -0.5713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8856 -0.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8856 2.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 2.4376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8618 -0.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6589 -0.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5305 0.8790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7334 0.8821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8646 1.0190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4522 -1.4056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 0.2035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8521 -2.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.0669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -1.0669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 2.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 2.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5841 -2.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3161 -2.2344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6546 0.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4542 -1.4365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0607 0.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4605 0.1835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5824 -2.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5086 -2.9290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 25 1 0 0 0 0 2 18 1 0 0 0 0 2 26 1 0 0 0 0 3 27 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 5 24 1 0 0 0 0 5 27 1 0 0 0 0 5 56 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 6 57 1 0 0 0 0 7 29 1 0 0 0 0 7 62 1 0 0 0 0 7 63 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 11 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 19 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 17 1 0 0 0 0 15 44 1 0 0 0 0 16 18 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 46 1 0 0 0 0 21 23 2 0 0 0 0 21 47 1 0 0 0 0 22 24 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 31 2 0 0 0 0 30 32 1 0 0 0 0 30 58 1 0 0 0 0 31 33 1 0 0 0 0 31 59 1 0 0 0 0 32 33 2 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 M END $$$$