B36EFZ
-OEChem-04042106123D
73 77 0 1 0 0 0 0 0999 V2000
-0.5108 -0.4187 1.3781 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8709 -2.5938 1.4976 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4550 -4.6914 -1.3353 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9817 2.4289 -2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.2029 1.8425 1.1216 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3905 -0.7897 0.1108 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9506 -4.1095 0.4163 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1271 1.1140 -0.6091 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5139 -7.2822 -0.3919 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7839 -2.6788 0.3074 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7588 -0.2788 0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1058 -2.0277 0.7118 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4358 -0.0125 -0.6296 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3840 -2.2181 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0966 0.1467 -0.2097 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8226 1.0525 0.8806 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3286 2.1981 0.2451 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7896 0.9186 -0.9799 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8516 0.6468 -1.8018 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3087 -5.0074 -0.4253 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6482 -6.4526 -0.0835 C 0 0 2 0 0 0 0 0 0 0 0 0
3.3575 1.1141 2.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3633 3.4235 0.9524 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3636 1.5322 -2.1558 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9581 1.4025 -2.5624 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8010 2.1545 -1.0767 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3915 2.3190 2.8899 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8909 3.4672 2.2743 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8693 4.5692 0.3169 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8555 -6.9163 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3004 3.3025 -1.6923 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3346 4.5075 -0.9969 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1099 1.8319 -1.2955 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5093 -7.1906 0.6656 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4528 1.8336 -0.6582 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5961 1.9943 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5697 1.6756 0.7228 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8562 1.9974 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8298 1.6787 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9730 1.8397 0.5381 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2495 1.6764 2.5379 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5863 -2.4723 -0.7509 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2081 -0.3522 -0.8004 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3769 -0.9651 0.7838 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3256 -2.5787 0.7341 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3158 -2.6505 2.1693 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5521 -4.4657 1.1539 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8476 0.5143 -2.2071 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9069 -6.5405 0.9795 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9717 0.2304 2.6959 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9689 2.1366 -2.8117 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2958 1.8755 -3.4802 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8449 1.2529 -1.6738 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0306 2.3661 3.9133 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9081 4.3981 2.8371 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3889 0.6181 0.2379 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9059 5.5217 0.8415 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7281 -6.2893 -0.6743 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6679 -6.8514 -1.9671 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1193 -7.9520 -0.6491 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2258 -8.2569 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6706 3.2546 -2.7124 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7252 5.4004 -1.4762 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8803 -6.1685 0.7922 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1168 -7.5496 1.6229 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3694 -7.8158 0.4057 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5276 2.1137 -2.5191 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7070 1.5865 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7434 2.1220 -1.4579 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8484 1.5599 2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3040 1.7016 2.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7534 2.5038 3.0566 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8562 0.7004 2.8419 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 15 1 0 0 0 0
2 12 2 0 0 0 0
3 20 2 0 0 0 0
4 33 2 0 0 0 0
5 40 1 0 0 0 0
5 41 1 0 0 0 0
6 11 1 0 0 0 0
6 12 1 0 0 0 0
6 13 1 0 0 0 0
7 10 1 0 0 0 0
7 20 1 0 0 0 0
7 47 1 0 0 0 0
8 18 1 0 0 0 0
8 33 1 0 0 0 0
8 56 1 0 0 0 0
9 21 1 0 0 0 0
9 34 1 0 0 0 0
9 61 1 0 0 0 0
10 12 1 0 0 0 0
10 14 1 0 0 0 0
10 42 1 0 0 0 0
11 16 1 0 0 0 0
11 43 1 0 0 0 0
11 44 1 0 0 0 0
13 15 1 0 0 0 0
13 19 2 0 0 0 0
14 45 1 0 0 0 0
14 46 1 0 0 0 0
15 18 2 0 0 0 0
16 17 1 0 0 0 0
16 22 2 0 0 0 0
17 23 1 0 0 0 0
17 26 2 0 0 0 0
18 24 1 0 0 0 0
19 25 1 0 0 0 0
19 48 1 0 0 0 0
20 21 1 0 0 0 0
21 30 1 0 0 0 0
21 49 1 0 0 0 0
22 27 1 0 0 0 0
22 50 1 0 0 0 0
23 28 1 0 0 0 0
23 29 2 0 0 0 0
24 25 2 0 0 0 0
24 51 1 0 0 0 0
25 52 1 0 0 0 0
26 31 1 0 0 0 0
26 53 1 0 0 0 0
27 28 2 0 0 0 0
27 54 1 0 0 0 0
28 55 1 0 0 0 0
29 32 1 0 0 0 0
29 57 1 0 0 0 0
30 58 1 0 0 0 0
30 59 1 0 0 0 0
30 60 1 0 0 0 0
31 32 2 0 0 0 0
31 62 1 0 0 0 0
32 63 1 0 0 0 0
33 35 1 0 0 0 0
34 64 1 0 0 0 0
34 65 1 0 0 0 0
34 66 1 0 0 0 0
35 36 2 0 0 0 0
35 37 1 0 0 0 0
36 38 1 0 0 0 0
36 67 1 0 0 0 0
37 39 2 0 0 0 0
37 68 1 0 0 0 0
38 40 2 0 0 0 0
38 69 1 0 0 0 0
39 40 1 0 0 0 0
39 70 1 0 0 0 0
41 71 1 0 0 0 0
41 72 1 0 0 0 0
41 73 1 0 0 0 0
M END
$$$$