0 mol 11 unq 0 iso 0 dist 5.96346 10.7734 7.98326 9.62262 7.46578 8.00765 4.10106 6.859 9.74251 6.56765 numMergedOcc 0
1 mol 11 unq 0 iso 1 dist 5.96346 9.62262 7.46578 10.7734 7.98326 8.00765 4.10106 6.859 6.56765 9.74251 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 7.51452 10.0815 5.86181 13.457 6.3253 9.9801 16.3456 9.07213 10.2902 5.22924 numMergedOcc 0
3 mol 20 unq 0 iso 1 dist 7.51452 13.457 6.3253 10.0815 5.86181 9.9801 16.3456 9.07213 5.22924 10.2902 numMergedOcc 0
4 mol 20 unq 1 iso 0 dist 7.51452 10.0815 5.86181 11.3821 5.80568 5.64041 16.3456 9.07213 10.2902 9.92781 numMergedOcc 0
5 mol 20 unq 1 iso 1 dist 7.51452 11.3821 5.80568 10.0815 5.86181 5.64041 16.3456 9.07213 9.92781 10.2902 numMergedOcc 0
6 mol 20 unq 1 iso 0 dist 7.51452 13.457 6.3253 11.3821 5.80568 7.57412 16.3456 9.07213 5.22924 9.92781 numMergedOcc 0
7 mol 20 unq 1 iso 1 dist 7.51452 11.3821 5.80568 13.457 6.3253 7.57412 16.3456 9.07213 9.92781 5.22924 numMergedOcc 0
8 mol 20 unq 2 iso 0 dist 6.09764 8.96335 4.74809 6.05944 7.43882 9.9801 4.95725 7.14069 10.5097 10.3149 numMergedOcc 0
9 mol 20 unq 2 iso 1 dist 6.09764 6.05944 7.43882 8.96335 4.74809 9.9801 4.95725 7.14069 10.3149 10.5097 numMergedOcc 0
10 mol 20 unq 3 iso 0 dist 6.09764 8.96335 4.74809 6.05944 7.43882 9.9801 5.84217 8.58641 12.7656 9.84883 numMergedOcc 0
11 mol 20 unq 3 iso 1 dist 6.09764 6.05944 7.43882 8.96335 4.74809 9.9801 5.84217 8.58641 9.84883 12.7656 numMergedOcc 0
12 mol 20 unq 4 iso 0 dist 6.09764 8.96335 4.74809 6.05944 7.43882 9.9801 4.18921 5.99466 10.2902 5.22924 numMergedOcc 0
13 mol 20 unq 4 iso 1 dist 6.09764 6.05944 7.43882 8.96335 4.74809 9.9801 4.18921 5.99466 5.22924 10.2902 numMergedOcc 0
14 mol 20 unq 5 iso 0 dist 6.09764 8.96335 4.74809 7.46656 7.31198 5.64041 4.95725 7.14069 10.5097 11.2406 numMergedOcc 0
15 mol 20 unq 5 iso 1 dist 6.09764 7.46656 7.31198 8.96335 4.74809 5.64041 4.95725 7.14069 11.2406 10.5097 numMergedOcc 0
16 mol 20 unq 6 iso 0 dist 6.09764 8.96335 4.74809 7.46656 7.31198 5.64041 5.84217 8.58641 12.7656 13.0235 numMergedOcc 0
17 mol 20 unq 6 iso 1 dist 6.09764 7.46656 7.31198 8.96335 4.74809 5.64041 5.84217 8.58641 13.0235 12.7656 numMergedOcc 0
18 mol 20 unq 7 iso 0 dist 6.09764 8.96335 4.74809 7.46656 7.31198 5.64041 4.18921 5.99466 10.2902 9.92781 numMergedOcc 0
19 mol 20 unq 7 iso 1 dist 6.09764 7.46656 7.31198 8.96335 4.74809 5.64041 4.18921 5.99466 9.92781 10.2902 numMergedOcc 0
20 mol 20 unq 5 iso 0 dist 6.09764 6.05944 7.43882 7.46656 7.31198 7.57412 4.95725 7.14069 10.3149 11.2406 numMergedOcc 0
21 mol 20 unq 5 iso 1 dist 6.09764 7.46656 7.31198 6.05944 7.43882 7.57412 4.95725 7.14069 11.2406 10.3149 numMergedOcc 0
22 mol 20 unq 6 iso 0 dist 6.09764 6.05944 7.43882 7.46656 7.31198 7.57412 5.84217 8.58641 9.84883 13.0235 numMergedOcc 0
23 mol 20 unq 6 iso 1 dist 6.09764 7.46656 7.31198 6.05944 7.43882 7.57412 5.84217 8.58641 13.0235 9.84883 numMergedOcc 0
24 mol 20 unq 7 iso 0 dist 6.09764 6.05944 7.43882 7.46656 7.31198 7.57412 4.18921 5.99466 5.22924 9.92781 numMergedOcc 0
25 mol 20 unq 7 iso 1 dist 6.09764 7.46656 7.31198 6.05944 7.43882 7.57412 4.18921 5.99466 9.92781 5.22924 numMergedOcc 0
26 mol 20 unq 8 iso 0 dist 9.20198 8.96335 5.86181 6.05944 6.3253 9.9801 4.18921 9.07213 10.2902 5.22924 numMergedOcc 0
27 mol 20 unq 8 iso 1 dist 9.20198 6.05944 6.3253 8.96335 5.86181 9.9801 4.18921 9.07213 5.22924 10.2902 numMergedOcc 0
28 mol 20 unq 9 iso 0 dist 9.20198 8.96335 5.86181 7.46656 5.80568 5.64041 4.18921 9.07213 10.2902 9.92781 numMergedOcc 0
29 mol 20 unq 9 iso 1 dist 9.20198 7.46656 5.80568 8.96335 5.86181 5.64041 4.18921 9.07213 9.92781 10.2902 numMergedOcc 0
30 mol 20 unq 9 iso 0 dist 9.20198 6.05944 6.3253 7.46656 5.80568 7.57412 4.18921 9.07213 5.22924 9.92781 numMergedOcc 0
31 mol 20 unq 9 iso 1 dist 9.20198 7.46656 5.80568 6.05944 6.3253 7.57412 4.18921 9.07213 9.92781 5.22924 numMergedOcc 0
32 mol 24 unq 0 iso 0 dist 9.41441 4.32034 8.00171 12.2662 5.95834 10.3279 9.88364 9.85784 5.70626 11.6859 numMergedOcc 0
33 mol 24 unq 0 iso 1 dist 9.41441 12.2662 5.95834 4.32034 8.00171 10.3279 9.88364 9.85784 11.6859 5.70626 numMergedOcc 0
34 mol 24 unq 1 iso 0 dist 9.41441 4.32034 8.00171 12.2662 5.95834 10.3279 9.78753 9.87996 5.62738 9.80106 numMergedOcc 0
35 mol 24 unq 1 iso 1 dist 9.41441 12.2662 5.95834 4.32034 8.00171 10.3279 9.78753 9.87996 9.80106 5.62738 numMergedOcc 0
36 mol 24 unq 2 iso 0 dist 9.41441 4.32034 8.00171 8.67951 4.2121 7.88693 9.88364 9.85784 5.70626 11.076 numMergedOcc 0
37 mol 24 unq 2 iso 1 dist 9.41441 8.67951 4.2121 4.32034 8.00171 7.88693 9.88364 9.85784 11.076 5.70626 numMergedOcc 0
38 mol 24 unq 3 iso 0 dist 9.41441 4.32034 8.00171 8.67951 4.2121 7.88693 9.78753 9.87996 5.62738 9.68535 numMergedOcc 0
39 mol 24 unq 3 iso 1 dist 9.41441 8.67951 4.2121 4.32034 8.00171 7.88693 9.78753 9.87996 9.68535 5.62738 numMergedOcc 0
40 mol 24 unq 4 iso 0 dist 9.41441 4.32034 8.00171 8.52463 6.72323 10.2653 9.88364 9.85784 5.70626 14.6305 numMergedOcc 0
41 mol 24 unq 4 iso 1 dist 9.41441 8.52463 6.72323 4.32034 8.00171 10.2653 9.88364 9.85784 14.6305 5.70626 numMergedOcc 0
42 mol 24 unq 5 iso 0 dist 9.41441 4.32034 8.00171 8.52463 6.72323 10.2653 9.78753 9.87996 5.62738 14.3224 numMergedOcc 0
43 mol 24 unq 5 iso 1 dist 9.41441 8.52463 6.72323 4.32034 8.00171 10.2653 9.78753 9.87996 14.3224 5.62738 numMergedOcc 0
44 mol 24 unq 2 iso 0 dist 9.41441 12.2662 5.95834 8.67951 4.2121 4.15946 9.88364 9.85784 11.6859 11.076 numMergedOcc 0
45 mol 24 unq 2 iso 1 dist 9.41441 8.67951 4.2121 12.2662 5.95834 4.15946 9.88364 9.85784 11.076 11.6859 numMergedOcc 0
46 mol 24 unq 3 iso 0 dist 9.41441 12.2662 5.95834 8.67951 4.2121 4.15946 9.78753 9.87996 9.80106 9.68535 numMergedOcc 0
47 mol 24 unq 3 iso 1 dist 9.41441 8.67951 4.2121 12.2662 5.95834 4.15946 9.78753 9.87996 9.68535 9.80106 numMergedOcc 0
48 mol 24 unq 4 iso 0 dist 9.41441 12.2662 5.95834 8.52463 6.72323 9.92026 9.88364 9.85784 11.6859 14.6305 numMergedOcc 0
49 mol 24 unq 4 iso 1 dist 9.41441 8.52463 6.72323 12.2662 5.95834 9.92026 9.88364 9.85784 14.6305 11.6859 numMergedOcc 0
50 mol 24 unq 5 iso 0 dist 9.41441 12.2662 5.95834 8.52463 6.72323 9.92026 9.78753 9.87996 9.80106 14.3224 numMergedOcc 0
51 mol 24 unq 5 iso 1 dist 9.41441 8.52463 6.72323 12.2662 5.95834 9.92026 9.78753 9.87996 14.3224 9.80106 numMergedOcc 0
52 mol 24 unq 4 iso 0 dist 9.41441 8.67951 4.2121 8.52463 6.72323 6.16544 9.88364 9.85784 11.076 14.6305 numMergedOcc 0
53 mol 24 unq 4 iso 1 dist 9.41441 8.52463 6.72323 8.67951 4.2121 6.16544 9.88364 9.85784 14.6305 11.076 numMergedOcc 0
54 mol 24 unq 5 iso 0 dist 9.41441 8.67951 4.2121 8.52463 6.72323 6.16544 9.78753 9.87996 9.68535 14.3224 numMergedOcc 0
55 mol 24 unq 5 iso 1 dist 9.41441 8.52463 6.72323 8.67951 4.2121 6.16544 9.78753 9.87996 14.3224 9.68535 numMergedOcc 0
56 mol 24 unq 6 iso 0 dist 6.73939 6.56748 5.95834 4.50066 4.2121 4.15946 15.4313 9.85784 11.6859 11.076 numMergedOcc 0
57 mol 24 unq 6 iso 1 dist 6.73939 4.50066 4.2121 6.56748 5.95834 4.15946 15.4313 9.85784 11.076 11.6859 numMergedOcc 0
58 mol 24 unq 7 iso 0 dist 6.73939 6.56748 5.95834 4.50066 4.2121 4.15946 14.1829 9.87996 9.80106 9.68535 numMergedOcc 0
59 mol 24 unq 7 iso 1 dist 6.73939 4.50066 4.2121 6.56748 5.95834 4.15946 14.1829 9.87996 9.68535 9.80106 numMergedOcc 0
60 mol 24 unq 8 iso 0 dist 6.73939 6.56748 5.95834 11.9112 8.00171 10.3279 15.4313 9.85784 11.6859 5.70626 numMergedOcc 0
61 mol 24 unq 8 iso 1 dist 6.73939 11.9112 8.00171 6.56748 5.95834 10.3279 15.4313 9.85784 5.70626 11.6859 numMergedOcc 0
62 mol 24 unq 9 iso 0 dist 6.73939 6.56748 5.95834 11.9112 8.00171 10.3279 14.1829 9.87996 9.80106 5.62738 numMergedOcc 0
63 mol 24 unq 9 iso 1 dist 6.73939 11.9112 8.00171 6.56748 5.95834 10.3279 14.1829 9.87996 5.62738 9.80106 numMergedOcc 0
64 mol 24 unq 10 iso 0 dist 6.73939 6.56748 5.95834 5.11617 6.72323 9.92026 15.4313 9.85784 11.6859 14.6305 numMergedOcc 0
65 mol 24 unq 10 iso 1 dist 6.73939 5.11617 6.72323 6.56748 5.95834 9.92026 15.4313 9.85784 14.6305 11.6859 numMergedOcc 0
66 mol 24 unq 11 iso 0 dist 6.73939 6.56748 5.95834 5.11617 6.72323 9.92026 14.1829 9.87996 9.80106 14.3224 numMergedOcc 0
67 mol 24 unq 11 iso 1 dist 6.73939 5.11617 6.72323 6.56748 5.95834 9.92026 14.1829 9.87996 14.3224 9.80106 numMergedOcc 0
68 mol 24 unq 8 iso 0 dist 6.73939 4.50066 4.2121 11.9112 8.00171 7.88693 15.4313 9.85784 11.076 5.70626 numMergedOcc 0
69 mol 24 unq 8 iso 1 dist 6.73939 11.9112 8.00171 4.50066 4.2121 7.88693 15.4313 9.85784 5.70626 11.076 numMergedOcc 0
70 mol 24 unq 9 iso 0 dist 6.73939 4.50066 4.2121 11.9112 8.00171 7.88693 14.1829 9.87996 9.68535 5.62738 numMergedOcc 0
71 mol 24 unq 9 iso 1 dist 6.73939 11.9112 8.00171 4.50066 4.2121 7.88693 14.1829 9.87996 5.62738 9.68535 numMergedOcc 0
72 mol 24 unq 10 iso 0 dist 6.73939 4.50066 4.2121 5.11617 6.72323 6.16544 15.4313 9.85784 11.076 14.6305 numMergedOcc 0
73 mol 24 unq 10 iso 1 dist 6.73939 5.11617 6.72323 4.50066 4.2121 6.16544 15.4313 9.85784 14.6305 11.076 numMergedOcc 0
74 mol 24 unq 11 iso 0 dist 6.73939 4.50066 4.2121 5.11617 6.72323 6.16544 14.1829 9.87996 9.68535 14.3224 numMergedOcc 0
75 mol 24 unq 11 iso 1 dist 6.73939 5.11617 6.72323 4.50066 4.2121 6.16544 14.1829 9.87996 14.3224 9.68535 numMergedOcc 0
76 mol 24 unq 10 iso 0 dist 6.73939 11.9112 8.00171 5.11617 6.72323 10.2653 15.4313 9.85784 5.70626 14.6305 numMergedOcc 0
77 mol 24 unq 10 iso 1 dist 6.73939 5.11617 6.72323 11.9112 8.00171 10.2653 15.4313 9.85784 14.6305 5.70626 numMergedOcc 0
78 mol 24 unq 11 iso 0 dist 6.73939 11.9112 8.00171 5.11617 6.72323 10.2653 14.1829 9.87996 5.62738 14.3224 numMergedOcc 0
79 mol 24 unq 11 iso 1 dist 6.73939 5.11617 6.72323 11.9112 8.00171 10.2653 14.1829 9.87996 14.3224 5.62738 numMergedOcc 0
80 mol 25 unq 0 iso 0 dist 8.87757 7.33728 6.25843 13.9331 8.88938 12.6805 4.69295 9.16515 4.98822 13.4321 numMergedOcc 0
81 mol 25 unq 0 iso 1 dist 8.87757 13.9331 8.88938 7.33728 6.25843 12.6805 4.69295 9.16515 13.4321 4.98822 numMergedOcc 0
82 mol 25 unq 1 iso 0 dist 8.87757 7.33728 6.25843 13.9331 8.88938 12.6805 8.79309 9.82987 7.91914 9.66912 numMergedOcc 0
83 mol 25 unq 1 iso 1 dist 8.87757 13.9331 8.88938 7.33728 6.25843 12.6805 8.79309 9.82987 9.66912 7.91914 numMergedOcc 0
84 mol 25 unq 2 iso 0 dist 8.87757 7.33728 6.25843 13.9331 8.88938 12.6805 14.9206 9.40732 10.9145 5.86134 numMergedOcc 0
85 mol 25 unq 2 iso 1 dist 8.87757 13.9331 8.88938 7.33728 6.25843 12.6805 14.9206 9.40732 5.86134 10.9145 numMergedOcc 0
86 mol 25 unq 3 iso 0 dist 8.87757 7.33728 6.25843 13.9331 8.88938 12.6805 13.6145 6.53269 9.62058 5.38592 numMergedOcc 0
87 mol 25 unq 3 iso 1 dist 8.87757 13.9331 8.88938 7.33728 6.25843 12.6805 13.6145 6.53269 5.38592 9.62058 numMergedOcc 0
88 mol 25 unq 4 iso 0 dist 8.50222 9.34396 6.25843 10.5328 8.88938 12.6805 13.2447 9.16515 4.98822 13.4321 numMergedOcc 0
89 mol 25 unq 4 iso 1 dist 8.50222 10.5328 8.88938 9.34396 6.25843 12.6805 13.2447 9.16515 13.4321 4.98822 numMergedOcc 0
90 mol 25 unq 5 iso 0 dist 8.50222 9.34396 6.25843 10.5328 8.88938 12.6805 11.8139 9.82987 7.91914 9.66912 numMergedOcc 0
91 mol 25 unq 5 iso 1 dist 8.50222 10.5328 8.88938 9.34396 6.25843 12.6805 11.8139 9.82987 9.66912 7.91914 numMergedOcc 0
92 mol 25 unq 6 iso 0 dist 8.50222 9.34396 6.25843 10.5328 8.88938 12.6805 6.28979 9.40732 10.9145 5.86134 numMergedOcc 0
93 mol 25 unq 6 iso 1 dist 8.50222 10.5328 8.88938 9.34396 6.25843 12.6805 6.28979 9.40732 5.86134 10.9145 numMergedOcc 0
94 mol 25 unq 7 iso 0 dist 8.50222 9.34396 6.25843 10.5328 8.88938 12.6805 5.18617 6.53269 9.62058 5.38592 numMergedOcc 0
95 mol 25 unq 7 iso 1 dist 8.50222 10.5328 8.88938 9.34396 6.25843 12.6805 5.18617 6.53269 5.38592 9.62058 numMergedOcc 0
96 mol 25 unq 8 iso 0 dist 7.55264 10.8498 6.25843 10.4337 8.88938 12.6805 14.9982 9.16515 4.98822 13.4321 numMergedOcc 0
97 mol 25 unq 8 iso 1 dist 7.55264 10.4337 8.88938 10.8498 6.25843 12.6805 14.9982 9.16515 13.4321 4.98822 numMergedOcc 0
98 mol 25 unq 9 iso 0 dist 7.55264 10.8498 6.25843 10.4337 8.88938 12.6805 14.1251 9.82987 7.91914 9.66912 numMergedOcc 0
99 mol 25 unq 9 iso 1 dist 7.55264 10.4337 8.88938 10.8498 6.25843 12.6805 14.1251 9.82987 9.66912 7.91914 numMergedOcc 0
100 mol 25 unq 10 iso 0 dist 7.55264 10.8498 6.25843 10.4337 8.88938 12.6805 8.41421 9.40732 10.9145 5.86134 numMergedOcc 0
101 mol 25 unq 10 iso 1 dist 7.55264 10.4337 8.88938 10.8498 6.25843 12.6805 8.41421 9.40732 5.86134 10.9145 numMergedOcc 0
102 mol 25 unq 11 iso 0 dist 7.55264 10.8498 6.25843 10.4337 8.88938 12.6805 5.68041 6.53269 9.62058 5.38592 numMergedOcc 0
103 mol 25 unq 11 iso 1 dist 7.55264 10.4337 8.88938 10.8498 6.25843 12.6805 5.68041 6.53269 5.38592 9.62058 numMergedOcc 0
104 mol 141 unq 0 iso 0 dist 9.97343 9.74444 9.10042 6.91919 9.75059 4.72386 13.4066 6.65731 14.0725 13.1981 numMergedOcc 0
105 mol 141 unq 0 iso 1 dist 9.97343 6.91919 9.75059 9.74444 9.10042 4.72386 13.4066 6.65731 13.1981 14.0725 numMergedOcc 0
106 mol 141 unq 1 iso 0 dist 9.97343 9.74444 9.10042 10.1432 6.83404 13.0212 13.4066 6.65731 14.0725 3.98068 numMergedOcc 0
107 mol 141 unq 1 iso 1 dist 9.97343 10.1432 6.83404 9.74444 9.10042 13.0212 13.4066 6.65731 3.98068 14.0725 numMergedOcc 0
108 mol 141 unq 1 iso 0 dist 9.97343 6.91919 9.75059 10.1432 6.83404 11.0187 13.4066 6.65731 13.1981 3.98068 numMergedOcc 0
109 mol 141 unq 1 iso 1 dist 9.97343 10.1432 6.83404 6.91919 9.75059 11.0187 13.4066 6.65731 3.98068 13.1981 numMergedOcc 0
110 mol 141 unq 2 iso 0 dist 9.70413 10.3716 9.10042 7.87881 9.75059 4.72386 8.54432 6.65731 14.0725 13.1981 numMergedOcc 0
111 mol 141 unq 2 iso 1 dist 9.70413 7.87881 9.75059 10.3716 9.10042 4.72386 8.54432 6.65731 13.1981 14.0725 numMergedOcc 0
112 mol 141 unq 3 iso 0 dist 9.70413 10.3716 9.10042 7.27731 6.83404 13.0212 8.54432 6.65731 14.0725 3.98068 numMergedOcc 0
113 mol 141 unq 3 iso 1 dist 9.70413 7.27731 6.83404 10.3716 9.10042 13.0212 8.54432 6.65731 3.98068 14.0725 numMergedOcc 0
114 mol 141 unq 3 iso 0 dist 9.70413 7.87881 9.75059 7.27731 6.83404 11.0187 8.54432 6.65731 13.1981 3.98068 numMergedOcc 0
115 mol 141 unq 3 iso 1 dist 9.70413 7.27731 6.83404 7.87881 9.75059 11.0187 8.54432 6.65731 3.98068 13.1981 numMergedOcc 0
116 mol 171 unq 0 iso 0 dist 9.61462 11.5561 5.25109 10.844 8.21618 3.98338 7.5383 7.47964 11.4851 12.9811 numMergedOcc 0
117 mol 171 unq 0 iso 1 dist 9.61462 10.844 8.21618 11.5561 5.25109 3.98338 7.5383 7.47964 12.9811 11.4851 numMergedOcc 0
118 mol 171 unq 1 iso 0 dist 6.64834 6.45673 7.22518 4.78075 5.25109 7.9115 8.99935 9.34834 14.0016 10.0655 numMergedOcc 0
119 mol 171 unq 1 iso 1 dist 6.64834 4.78075 5.25109 6.45673 7.22518 7.9115 8.99935 9.34834 10.0655 14.0016 numMergedOcc 0
120 mol 171 unq 2 iso 0 dist 6.64834 6.45673 7.22518 4.78075 5.25109 7.9115 7.15048 5.74846 11.4302 4.88147 numMergedOcc 0
121 mol 171 unq 2 iso 1 dist 6.64834 4.78075 5.25109 6.45673 7.22518 7.9115 7.15048 5.74846 4.88147 11.4302 numMergedOcc 0
122 mol 171 unq 3 iso 0 dist 5.93786 5.48551 7.22518 7.9651 5.25109 7.9115 9.35703 9.34834 14.0016 10.0655 numMergedOcc 0
123 mol 171 unq 3 iso 1 dist 5.93786 7.9651 5.25109 5.48551 7.22518 7.9115 9.35703 9.34834 10.0655 14.0016 numMergedOcc 0
124 mol 171 unq 4 iso 0 dist 5.93786 5.48551 7.22518 7.9651 5.25109 7.9115 9.14311 5.74846 11.4302 4.88147 numMergedOcc 0
125 mol 171 unq 4 iso 1 dist 5.93786 7.9651 5.25109 5.48551 7.22518 7.9115 9.14311 5.74846 4.88147 11.4302 numMergedOcc 0
126 mol 171 unq 5 iso 0 dist 8.24693 8.05069 7.22518 12.6853 5.25109 7.9115 14.4375 9.34834 14.0016 10.0655 numMergedOcc 0
127 mol 171 unq 5 iso 1 dist 8.24693 12.6853 5.25109 8.05069 7.22518 7.9115 14.4375 9.34834 10.0655 14.0016 numMergedOcc 0
128 mol 171 unq 6 iso 0 dist 8.24693 8.05069 7.22518 12.6853 5.25109 7.9115 13.6262 5.74846 11.4302 4.88147 numMergedOcc 0
129 mol 171 unq 6 iso 1 dist 8.24693 12.6853 5.25109 8.05069 7.22518 7.9115 13.6262 5.74846 4.88147 11.4302 numMergedOcc 0
130 mol 171 unq 7 iso 0 dist 7.36698 11.2785 7.22518 5.90026 5.25109 7.9115 4.66982 9.34834 14.0016 10.0655 numMergedOcc 0
131 mol 171 unq 7 iso 1 dist 7.36698 5.90026 5.25109 11.2785 7.22518 7.9115 4.66982 9.34834 10.0655 14.0016 numMergedOcc 0
132 mol 171 unq 8 iso 0 dist 7.36698 11.2785 7.22518 5.90026 5.25109 7.9115 3.65288 5.74846 11.4302 4.88147 numMergedOcc 0
133 mol 171 unq 8 iso 1 dist 7.36698 5.90026 5.25109 11.2785 7.22518 7.9115 3.65288 5.74846 4.88147 11.4302 numMergedOcc 0
134 mol 181 unq 0 iso 0 dist 6.59025 7.81713 8.86197 7.16549 5.94379 11.5564 6.28125 9.88897 5.3698 9.56782 numMergedOcc 0
135 mol 181 unq 0 iso 1 dist 6.59025 7.16549 5.94379 7.81713 8.86197 11.5564 6.28125 9.88897 9.56782 5.3698 numMergedOcc 0
136 mol 232 unq 0 iso 0 dist 8.50102 6.2188 9.78181 12.3508 9.8664 16.4381 9.74344 9.9183 14.876 11.2243 numMergedOcc 0
137 mol 232 unq 0 iso 1 dist 8.50102 12.3508 9.8664 6.2188 9.78181 16.4381 9.74344 9.9183 11.2243 14.876 numMergedOcc 0
138 mol 232 unq 1 iso 0 dist 9.40808 12.5452 9.78181 8.80479 9.8664 16.4381 5.10213 9.9183 14.876 11.2243 numMergedOcc 0
139 mol 232 unq 1 iso 1 dist 9.40808 8.80479 9.8664 12.5452 9.78181 16.4381 5.10213 9.9183 11.2243 14.876 numMergedOcc 0
140 mol 244 unq 0 iso 0 dist 5.50492 7.6169 7.95359 5.17744 6.22122 10.6423 6.1597 6.53416 3.92686 10.3324 numMergedOcc 0
141 mol 244 unq 0 iso 1 dist 5.50492 5.17744 6.22122 7.6169 7.95359 10.6423 6.1597 6.53416 10.3324 3.92686 numMergedOcc 0
142 mol 274 unq 0 iso 0 dist 8.52587 6.20558 6.88827 16.3619 9.16942 11.6106 16.9539 8.60027 13.3632 5.39432 numMergedOcc 0
143 mol 274 unq 0 iso 1 dist 8.52587 16.3619 9.16942 6.20558 6.88827 11.6106 16.9539 8.60027 5.39432 13.3632 numMergedOcc 0
144 mol 274 unq 1 iso 0 dist 6.39866 6.16703 6.88827 5.64601 9.16942 11.6106 8.87855 8.60027 13.3632 5.39432 numMergedOcc 0
145 mol 274 unq 1 iso 1 dist 6.39866 5.64601 9.16942 6.16703 6.88827 11.6106 8.87855 8.60027 5.39432 13.3632 numMergedOcc 0
