ATOM 75
1 S2a S 18.2000 -21.7700
2 C1b C 19.3900 -21.0700
3 C1b C 20.6500 -21.7700
4 N1b N 21.8400 -21.0700
5 C5a C 23.0300 -21.7700
6 C1b C 24.2900 -21.0700
7 C1b C 25.4800 -21.7700
8 N1b N 26.6700 -21.0700
9 C5a C 27.9300 -21.7700
10 C1c C 29.1200 -21.0700
11 C1d C 30.3100 -21.7700
12 C1b C 31.5000 -21.0700
13 O2b O 32.7600 -21.7700
14 O5a O 23.0300 -23.1700
15 O5a O 27.9300 -23.1700
16 O1a O 29.1200 -19.6700
17 C1a C 30.3100 -20.3700
18 C1a C 30.3100 -23.1700
19 P1b P 34.1600 -21.7700
20 O1c O 35.5600 -21.7700
21 O1c O 34.1600 -23.1700
22 C1y C 27.6500 -16.8000
23 C1y C 29.0500 -16.8000
24 C1y C 29.4700 -15.4700
25 O2x O 28.3500 -14.6300
26 C1y C 27.2300 -15.4700
27 C1b C 30.8000 -15.0500
28 O1a O 26.8100 -17.9200
29 O2b O 29.8900 -17.9200
30 P1b P 31.2900 -17.9200
31 O1c O 31.2900 -16.5200
32 O1c O 32.6900 -17.9200
33 O1c O 31.2900 -19.3200
34 C8y C 23.1000 -13.6500
35 C8y C 23.1000 -15.0500
36 N4y N 25.5500 -15.0500
37 C8x C 25.5500 -13.6500
38 N5x N 24.2900 -12.9500
39 C8y C 21.9100 -12.9500
40 N5x N 20.6500 -13.6500
41 C8x C 20.6500 -15.0500
42 N5x N 21.9100 -15.7500
43 N1a N 21.9100 -11.5500
44 O2b O 32.7600 -15.4700
45 P1b P 34.1600 -15.4700
46 O1c O 34.1600 -14.0700
47 O1c O 35.5600 -15.4700
48 O2c O 34.1600 -18.6900
49 C1y C 10.6400 -25.7600
50 C1y C 11.8300 -25.1300
51 C1y C 9.4500 -25.0600
52 C1x C 10.6400 -27.1600
53 C1z C 11.8300 -23.6600
54 C1x C 14.1400 -25.0600
55 C1z C 8.1900 -25.7600
56 C1x C 9.4500 -23.6600
57 C1x C 9.4500 -27.8600
58 C1y C 12.9500 -23.0300
59 C1y C 10.6400 -22.9600
60 C1a C 11.8300 -22.5400
61 C1x C 14.1400 -23.7300
62 C1y C 8.1900 -27.0900
63 C1x C 7.0000 -25.0600
64 C1a C 8.1900 -24.3600
65 C1c C 13.0200 -21.6300
66 O1a O 10.6400 -21.9800
67 C1x C 7.0000 -27.7900
68 C1x C 5.8100 -25.7600
69 C1b C 14.2100 -20.9300
70 C1a C 11.9000 -20.5800
71 C1y C 5.8100 -27.0900
72 C1b C 15.4000 -21.6300
73 O1a O 4.5500 -27.7900
74 C5a C 16.5900 -21.0000
75 O5a O 16.5900 -19.6000
BOND 81
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 5 14 2
14 9 15 2
15 10 16 1 #Down
16 11 17 1
17 11 18 1
18 13 19 1
19 19 20 2
20 19 21 1
21 22 23 1
22 23 24 1
23 24 25 1
24 25 26 1
25 22 26 1
26 24 27 1 #Down
27 22 28 1 #Up
28 23 29 1 #Up
29 29 30 1
30 30 31 1
31 30 32 1
32 30 33 2
33 34 35 2
34 35 36 1
35 36 37 1
36 37 38 2
37 34 38 1
38 34 39 1
39 39 40 2
40 40 41 1
41 41 42 2
42 35 42 1
43 39 43 1
44 26 36 1 #Down
45 27 44 1
46 44 45 1
47 45 46 1
48 45 47 2
49 45 48 1
50 19 48 1
51 49 50 1
52 49 51 1
53 49 52 1
54 50 53 1
55 50 54 1
56 51 55 1
57 51 56 1
58 52 57 1
59 53 58 1
60 53 59 1
61 53 60 1 #Up
62 54 61 1
63 55 62 1
64 55 63 1
65 55 64 1 #Up
66 58 65 1
67 59 66 1 #Down
68 62 67 1
69 63 68 1
70 65 69 1
71 65 70 1 #Down
72 67 71 1
73 69 72 1
74 71 73 1 #Down
75 72 74 1
76 74 75 2
77 56 59 1
78 57 62 1
79 58 61 1
80 68 71 1
81 1 74 1
| 
