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PMMA_3
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1991-06-07
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3KB
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62 lines
* Data from Allinger MM2/MMP2 program.
DATA
56
-3.15894, 1.81571, .52258, 1, 2, 3, 4, 5
-3.05016, 2.87597, .19907, 5, 1,
-2.68002, .84468, -.57472, 1, 1, 6, 7, 8
-4.23640, 1.66066, .76086, 5, 1,
-2.61298, 1.67427, 1.48138, 5, 1,
-2.78014, -.58697, -.03224, 3, 3, 15, 16,
-3.68931, .97055, -1.74498, 1, 3, 12, 13, 14
-1.26098, 1.16777, -1.12316, 1, 3, 9, 10, 11
-1.06568, .39516, -1.90092, 5, 8,
-1.32921, 2.12175, -1.69557, 5, 8,
.00075, 1.27900, -.20475, 1, 8, 23, 24, 25
-3.39933, .35574, -2.62766, 5, 7,
-4.71231, .64993, -1.44041, 5, 7,
-3.76569, 2.02380, -2.10029, 5, 7,
-3.03661, -.86295, 1.11002, 7, 6,
-2.56985, -1.51143, -1.00922, 6, 6, 17, 18, 19
-2.61143, -2.86719, -.61027, 1, 16, 20, 21, 22
-3.06251, -1.43194, -1.34053, 20, 16,
-2.00110, -1.39929, -1.16071, 20, 16,
-2.38591, -3.49404, -1.50220, 5, 17,
-1.84148, -3.06497, .17009, 5, 17,
-3.62935, -3.12425, -.23714, 5, 17,
1.26578, 1.17318, -1.11935, 1, 11, 26, 27, 28
-.00194, 2.66235, .48845, 1, 11, 29, 30, 31
.00048, .09709, .75992, 3, 11, 32, 33,
2.68263, .84525, -.56818, 1, 23, 40, 41, 42
1.07293, .40534, -1.90239, 5, 23,
1.33661, 2.13022, -1.68629, 5, 23,
.87416, 2.83403, 1.14453, 5, 24,
-.00580, 3.49176, -.25475, 5, 24,
-.87587, 2.82943, 1.14853, 5, 24,
.00161, -1.04609, .38920, 7, 25,
-.00408, .48162, 2.06186, 6, 25, 34, 35, 36
-.00532, -.55556, 3.02194, 1, 33, 37, 38, 39
.53519, .74102, 2.10030, 20, 33,
-.54458, .73890, 2.09690, 20, 33,
-.01351, -.08718, 4.03170, 5, 34,
-.91885, -1.18281, 2.90909, 5, 34,
.91510, -1.17450, 2.91965, 5, 34,
3.69601, .97562, -1.73437, 1, 26, 43, 44, 45
3.15774, 1.81129, .53502, 1, 26, 46, 47, 48
2.77964, -.58919, -.03239, 3, 26, 49, 50,
4.71770, .65299, -1.42756, 5, 40,
3.40866, .36496, -2.62079, 5, 40,
3.77437, 2.03036, -2.08477, 5, 40,
4.23347, 1.65281, .77876, 5, 41,
3.05348, 2.87295, .21461, 5, 41,
2.60566, 1.66786, 1.49004, 5, 41,
3.03263, -.87060, 1.10933, 7, 42,
2.57148, -1.50897, -1.01434, 6, 42, 51, 52, 53
2.61112, -2.86666, -.62175, 1, 50, 54, 55, 56
2.00328, -1.39569, -1.16718, 20, 50,
3.06510, -1.42823, -1.34390, 20, 50,
2.39168, -3.48925, -1.51818, 5, 51,
3.62668, -3.12528, -.24331, 5, 51,
1.83635, -3.06842, .15278, 5, 51,
LEGEND
PMMA/3