B4ET1D
-OEChem-04022103303D
43 44 0 0 0 0 0 0 0999 V2000
3.4710 -0.9394 -1.8958 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5060 2.1798 -0.0179 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4034 -1.0253 0.8098 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5965 -0.7501 0.5119 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0343 -0.7279 -0.0808 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3684 -0.0273 0.0867 N 0 0 0 0 0 0 0 0 0 0 0 0
1.0022 -1.6277 -0.5446 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0302 -0.8895 -1.4001 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3099 -2.3253 0.6286 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9388 0.0117 -0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6105 -1.3763 1.4028 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4999 0.1121 1.2736 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8137 0.3119 0.5658 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1856 -0.4604 -0.8007 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9720 1.3737 -0.3248 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8726 -0.5650 0.8008 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1390 0.4558 -0.0942 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1893 1.5587 -0.9804 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0899 -0.3800 0.1454 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2482 0.6818 -0.7452 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7778 1.7041 0.2628 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6641 2.7044 0.9542 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4886 -2.3892 -1.1664 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6507 -1.6271 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4666 -0.2874 -2.1705 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0537 -2.7508 1.3131 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2861 -3.1638 0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6726 0.4335 -1.2505 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3569 0.8478 -0.1488 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1269 -1.9681 2.1689 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0191 -0.6162 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0399 1.0802 1.5154 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7287 -0.3409 2.2488 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8919 -0.2563 0.8077 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1635 2.0767 -0.5062 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7622 -1.3977 1.4904 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3139 2.3878 -1.6708 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9145 -1.0629 0.3281 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1963 0.8263 -1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7834 3.5945 0.3275 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2115 3.0100 1.9035 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6634 2.3194 1.1761 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4465 3.0930 0.3114 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 2 0 0 0 0
2 21 1 0 0 0 0
2 43 1 0 0 0 0
3 6 2 0 0 0 0
4 10 1 0 0 0 0
4 11 1 0 0 0 0
4 12 1 0 0 0 0
5 7 1 0 0 0 0
5 14 1 0 0 0 0
5 34 1 0 0 0 0
6 17 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 23 1 0 0 0 0
8 10 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 11 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 13 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
13 15 2 0 0 0 0
13 16 1 0 0 0 0
14 17 1 0 0 0 0
15 18 1 0 0 0 0
15 35 1 0 0 0 0
16 19 2 0 0 0 0
16 36 1 0 0 0 0
17 21 2 0 0 0 0
18 20 2 0 0 0 0
18 37 1 0 0 0 0
19 20 1 0 0 0 0
19 38 1 0 0 0 0
20 39 1 0 0 0 0
21 22 1 0 0 0 0
22 40 1 0 0 0 0
22 41 1 0 0 0 0
22 42 1 0 0 0 0
M END
$$$$