ATOM 84
1 C1y C 27.8590 -23.4379
2 C8y C 26.6748 -22.6715
3 C1y C 29.1130 -22.7412
4 C8y C 26.6748 -21.2783
5 C8y C 25.4905 -23.3682
6 C1y C 29.1130 -21.3479
7 O1a O 30.2973 -23.4379
8 O2x O 27.9287 -20.6513
9 C8x C 25.4905 -20.5816
10 C8x C 24.3062 -22.6715
11 C8y C 24.3062 -21.2783
12 O1a O 23.0522 -20.5816
13 C8y C 30.2973 -20.6513
14 C8x C 31.4816 -21.3479
15 C8x C 30.2973 -19.2580
16 C8y C 32.7355 -20.6513
17 C8x C 31.5512 -18.5614
18 C8y C 32.7355 -19.2580
19 O1a O 33.9198 -21.3479
20 O1a O 33.9895 -18.5614
21 C8y C 27.8590 -25.3870
22 C8y C 29.1130 -26.0140
23 C8y C 26.6748 -26.0140
24 C8y C 29.1130 -27.4769
25 O2x O 30.2973 -25.3870
26 C8x C 26.6748 -27.4769
27 C1y C 30.2973 -28.1736
28 C8y C 27.8590 -28.1736
29 C1y C 31.4816 -26.0837
30 C1y C 31.4816 -27.4769
31 O1a O 32.6658 -28.1736
32 C8y C 32.7355 -25.3870
33 C8x C 33.9198 -26.0837
34 C8x C 32.7355 -23.9938
35 C8y C 35.1041 -25.3870
36 C8x C 33.9198 -23.2971
37 C8y C 35.1041 -23.9938
38 O1a O 36.3580 -26.0837
39 O1a O 36.3580 -23.2971
40 O1a O 25.4907 -25.3870
41 O1a O 25.4874 -24.4817
42 C8y C 30.2973 -30.1227
43 C8y C 29.1130 -30.8194
44 C8x C 29.1130 -32.2127
45 C8y C 30.2973 -32.9094
46 C8y C 31.4816 -32.2127
47 C8y C 31.4816 -30.8194
48 C1y C 32.6658 -32.9094
49 C1y C 33.9198 -32.2127
50 C1y C 33.9198 -30.8194
51 O2x O 32.6658 -30.1227
52 C8y C 35.1041 -30.1227
53 O1a O 35.1041 -32.9094
54 C8x C 36.2883 -30.8194
55 C8y C 37.5423 -30.1227
56 C8y C 37.5423 -28.7295
57 C8x C 36.2883 -28.0328
58 C8x C 35.1041 -28.7295
59 O1a O 27.8562 -29.2870
60 O1a O 27.8592 -30.1924
61 O1a O 38.7266 -28.0328
62 O1a O 38.7266 -30.8194
63 C8y C 32.6488 -34.7890
64 C8y C 31.4467 -35.4634
65 C8x C 31.4296 -36.8566
66 C8y C 32.6276 -37.5679
67 C8y C 33.8996 -36.8935
68 C8y C 33.8466 -35.5003
69 C1x C 35.0277 -37.6049
70 C1y C 36.2427 -36.9231
71 C1y C 36.2597 -35.5299
72 O2x O 35.0618 -34.8185
73 O1a O 30.2721 -34.0924
74 O1a O 30.3030 -34.9515
75 O1a O 32.6106 -38.9688
76 C8y C 37.4851 -34.8419
77 O1a O 37.4337 -37.6305
78 C8x C 38.6813 -35.5519
79 C8y C 39.8961 -34.8698
80 C8y C 39.9135 -33.4766
81 C8x C 38.7168 -32.7667
82 C8x C 37.5019 -33.4487
83 O1a O 41.1311 -32.7928
84 O1a O 41.1001 -35.5845
BOND 95
1 18 20 1
2 17 18 1
3 4 9 1
4 1 21 1 #Up
5 5 10 2
6 9 11 2
7 11 12 1
8 6 8 1
9 10 11 1
10 6 13 1 #Down
11 1 2 1
12 1 3 1
13 2 4 2
14 2 5 1
15 21 22 1
16 21 23 2
17 22 24 2
18 22 25 1
19 23 26 1
20 24 27 1
21 24 28 1
22 25 29 1
23 27 30 1
24 30 31 1 #Down
25 26 28 2
26 29 30 1
27 3 6 1
28 29 32 1 #Down
29 3 7 1 #Down
30 4 8 1
31 13 14 2
32 13 15 1
33 14 16 1
34 15 17 2
35 16 18 2
36 32 33 2
37 32 34 1
38 33 35 1
39 34 36 2
40 35 37 2
41 35 38 1
42 37 39 1
43 36 37 1
44 23 40 1
45 16 19 1
46 5 41 1
47 27 42 1 #Up
48 42 43 2
49 43 44 1
50 44 45 2
51 45 46 1
52 46 47 2
53 42 47 1
54 46 48 1
55 48 49 1
56 49 50 1
57 50 51 1
58 47 51 1
59 50 52 1 #Down
60 49 53 1 #Down
61 52 54 2
62 54 55 1
63 55 56 2
64 56 57 1
65 57 58 2
66 52 58 1
67 28 59 1
68 43 60 1
69 56 61 1
70 55 62 1
71 48 63 1 #Up
72 63 64 2
73 64 65 1
74 65 66 2
75 66 67 1
76 67 68 2
77 63 68 1
78 67 69 1
79 69 70 1
80 70 71 1
81 71 72 1
82 68 72 1
83 45 73 1
84 64 74 1
85 66 75 1
86 71 76 1 #Down
87 70 77 1 #Down
88 76 78 2
89 78 79 1
90 79 80 2
91 80 81 1
92 81 82 2
93 76 82 1
94 80 83 1
95 79 84 1
|