L4WPS8
-OEChem-05022323233D
52 53 0 1 0 0 0 0 0999 V2000
3.3201 1.0334 -1.8732 S 0 0 0 0 0 0 0 0 0 0 0 0
2.9793 2.4422 -1.9315 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7649 0.3403 -3.0670 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3771 -1.6256 1.6869 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0617 -1.9510 -1.9028 O 0 0 0 0 0 0 0 0 0 0 0 0
7.5560 0.3697 2.2092 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.0887 2.8266 0.0888 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8089 1.7331 1.6169 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7801 -2.6297 -0.4628 O 0 0 0 0 0 0 0 0 0 0 0 0
8.5383 -1.5673 0.5103 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0307 0.1677 -1.1873 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.9519 -0.2344 -0.0777 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.3718 -0.4670 -0.0224 C 0 0 1 0 0 0 0 0 0 0 0 0
1.4917 0.5712 0.1347 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0560 0.2064 0.3061 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1722 0.7187 -0.5456 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5857 0.8285 -0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6295 -0.4781 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2885 -1.0330 0.8455 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9423 1.1035 -0.0739 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0596 -0.8428 0.7954 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6313 -1.3751 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2849 0.7612 0.0855 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6575 -1.7077 -0.8532 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4623 -0.2536 -0.7364 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7090 1.7506 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4622 -0.4136 0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7088 1.5905 1.3423 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5854 0.5084 1.2623 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7540 -2.6141 -0.3558 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3178 1.7911 0.5052 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3671 -1.5500 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6391 -0.7026 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6057 1.6521 0.2757 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0903 0.0873 0.9157 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9374 -0.8297 -1.4175 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1843 0.3989 -0.8203 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6971 1.1589 -1.4298 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6031 0.3158 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4798 -1.7420 1.1424 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6861 2.0737 -0.4917 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8802 -2.3472 1.4224 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0312 1.4985 -0.1958 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3628 -0.9641 -1.5529 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0361 2.5991 0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7991 2.3120 2.1498 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6983 -2.0660 -0.3185 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8648 -3.4644 -1.0346 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4958 -2.9902 0.6373 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0618 -0.4454 2.0643 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1818 3.5152 0.7813 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3966 -3.3901 -0.5271 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 2 0 0 0 0
1 11 1 0 0 0 0
1 17 1 0 0 0 0
4 21 2 0 0 0 0
5 24 2 0 0 0 0
6 29 1 0 0 0 0
6 50 1 0 0 0 0
7 31 1 0 0 0 0
7 51 1 0 0 0 0
8 31 2 0 0 0 0
9 32 1 0 0 0 0
9 52 1 0 0 0 0
10 32 2 0 0 0 0
11 14 1 0 0 0 0
11 36 1 0 0 0 0
12 13 1 0 0 0 0
12 21 1 0 0 0 0
12 39 1 0 0 0 0
13 16 1 0 0 0 0
13 24 1 0 0 0 0
13 33 1 0 0 0 0
14 15 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 19 2 0 0 0 0
15 20 1 0 0 0 0
16 31 1 0 0 0 0
16 37 1 0 0 0 0
16 38 1 0 0 0 0
17 25 2 0 0 0 0
17 26 1 0 0 0 0
18 21 1 0 0 0 0
18 22 2 0 0 0 0
18 23 1 0 0 0 0
19 22 1 0 0 0 0
19 40 1 0 0 0 0
20 23 2 0 0 0 0
20 41 1 0 0 0 0
22 42 1 0 0 0 0
23 43 1 0 0 0 0
24 30 1 0 0 0 0
25 27 1 0 0 0 0
25 44 1 0 0 0 0
26 28 2 0 0 0 0
26 45 1 0 0 0 0
27 29 2 0 0 0 0
27 32 1 0 0 0 0
28 29 1 0 0 0 0
28 46 1 0 0 0 0
30 47 1 0 0 0 0
30 48 1 0 0 0 0
30 49 1 0 0 0 0
M END
$$$$