ATOM 24
1 C8x C 16.9531 -15.6229
2 C8x C 16.9531 -17.0243
3 C8x C 18.1667 -17.7250
4 C8y C 19.3803 -17.0243
5 C8y C 19.3803 -15.6229
6 C8y C 18.1667 -14.9223
7 C5x C 20.5939 -17.7250
8 C2y C 21.8075 -17.0243
9 C2y C 21.8075 -15.6229
10 C5x C 20.5939 -14.9223
11 C8y C 23.1403 -17.4573
12 C8y C 23.9640 -16.3236
13 C2y C 23.1403 -15.1899
14 C8y C 23.7104 -18.7376
15 C8x C 25.1040 -18.8840
16 C8y C 25.9277 -17.7503
17 C8x C 25.3578 -16.4701
18 O5x O 20.5939 -13.5209
19 O5x O 20.5939 -19.1264
20 C1a C 27.3128 -17.8958
21 O1a O 22.8913 -19.8645
22 N0 N 23.5674 -13.8748 #+
23 N2a N 23.9301 -12.5212 #-
24 O1a O 18.1667 -13.5223
BOND 27
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 8 11 1
13 11 12 2
14 12 13 1
15 9 13 1
16 11 14 1
17 14 15 2
18 15 16 1
19 16 17 2
20 12 17 1
21 10 18 2
22 7 19 2
23 16 20 1
24 14 21 1
25 13 22 2
26 22 23 2
27 6 24 1
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