ATOM 19
1 C8y C 28.5295 -16.9420
2 C1z C 29.8797 -16.5502
3 C8y C 28.5585 -18.3390
4 C8x C 27.3312 -16.2112
5 C1y C 30.6571 -17.7077
6 C1x C 30.7332 -15.4514
7 C1a C 29.1608 -15.3287
8 N1y N 29.8095 -18.8184
9 C8x C 27.2667 -19.0230
10 C8y C 26.0977 -16.8835
11 O2x O 32.0658 -17.3219
12 C1x C 32.0426 -15.9307
13 C1a C 30.1662 -20.1686
14 C8x C 26.1326 -18.2865
15 O7a O 24.8994 -16.1529
16 C7a C 23.6719 -16.8193
17 N1b N 22.4736 -16.0885
18 O6a O 23.6602 -18.2222
19 C1a C 21.2459 -16.7549
BOND 21
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1 #Up
7 3 8 1
8 3 9 1
9 4 10 2
10 5 11 1
11 6 12 1
12 8 13 1
13 9 14 2
14 10 15 1
15 15 16 1
16 16 17 1
17 16 18 2
18 17 19 1
19 5 8 1
20 10 14 1
21 11 12 1
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