0 mol 15 unq 0 iso 0 dist 9.97507 8.38064 9.03536 7.48342 12.1303 4.39605 5.17568 6.82505 10.4158 11.2317 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.31718 5.05803 6.92781 6.93532 10.4366 5.30082 10.8455 7.63133 12.5273 16.9082 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.4674 4.51865 5.80928 8.40416 9.74255 7.08342 7.67038 4.54938 6.864 7.75618 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.4674 4.51865 5.80928 8.40416 9.74255 7.08342 10.3915 7.82074 11.0366 12.3215 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 8.4674 4.54938 7.67038 6.41575 4.64838 4.97119 5.80928 4.51865 6.864 6.41423 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 8.4674 7.82074 10.3915 6.41575 4.64838 6.01808 5.80928 4.51865 11.0366 6.41423 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 4.54938 7.20519 7.34551 7.75618 9.74255 4.96411 7.67038 8.4674 10.4091 8.40416 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 4.54938 7.20519 7.34551 7.75618 9.74255 4.96411 5.03957 7.82074 12.1187 12.3215 numMergedOcc 0
8 mol 19 unq 6 iso 0 dist 4.54938 6.864 5.80928 7.75618 9.74255 7.08342 7.67038 8.4674 4.51865 8.40416 numMergedOcc 0
9 mol 19 unq 7 iso 0 dist 4.54938 6.864 5.80928 7.75618 9.74255 7.08342 5.03957 7.82074 11.0366 12.3215 numMergedOcc 0
10 mol 19 unq 8 iso 0 dist 4.54938 8.4674 7.67038 6.41575 4.97119 4.64838 7.34551 7.20519 10.4091 10.741 numMergedOcc 0
11 mol 19 unq 9 iso 0 dist 4.54938 8.4674 7.67038 6.41575 4.97119 4.64838 5.80928 6.864 4.51865 6.41423 numMergedOcc 0
12 mol 19 unq 10 iso 0 dist 4.54938 7.82074 5.03957 6.41575 4.97119 6.01808 7.34551 7.20519 12.1187 10.741 numMergedOcc 0
13 mol 19 unq 11 iso 0 dist 4.54938 7.82074 5.03957 6.41575 4.97119 6.01808 5.80928 6.864 11.0366 6.41423 numMergedOcc 0
14 mol 19 unq 12 iso 0 dist 4.51865 8.4674 5.80928 8.40416 7.08342 9.74255 7.67038 6.864 4.54938 7.75618 numMergedOcc 0
15 mol 19 unq 13 iso 0 dist 4.51865 6.864 7.67038 6.41423 4.64838 4.97119 5.80928 8.4674 4.54938 6.41575 numMergedOcc 0
16 mol 19 unq 14 iso 0 dist 6.864 7.20519 7.07775 7.75618 7.08342 4.96411 7.67038 4.51865 10.4091 8.40416 numMergedOcc 0
17 mol 19 unq 15 iso 0 dist 6.864 4.54938 5.80928 7.75618 7.08342 9.74255 7.67038 4.51865 8.4674 8.40416 numMergedOcc 0
18 mol 19 unq 16 iso 0 dist 6.864 4.51865 7.67038 6.41423 4.97119 4.64838 7.07775 7.20519 10.4091 10.741 numMergedOcc 0
19 mol 19 unq 17 iso 0 dist 6.864 4.51865 7.67038 6.41423 4.97119 4.64838 5.80928 4.54938 8.4674 6.41575 numMergedOcc 0
20 mol 24 unq 0 iso 0 dist 8.86116 8.38394 6.44287 8.60554 8.52463 12.3994 10.0952 6.86014 12.5077 7.29868 numMergedOcc 0
21 mol 24 unq 1 iso 0 dist 8.86116 8.38394 6.44287 8.44664 10.971 5.30734 10.0952 6.86014 12.5077 16.1126 numMergedOcc 0
22 mol 24 unq 2 iso 0 dist 8.86116 8.38394 6.44287 9.44691 13.4893 12.505 10.0952 6.86014 12.5077 15.8209 numMergedOcc 0
23 mol 24 unq 3 iso 0 dist 8.86116 6.86014 10.0952 9.41441 14.012 6.66749 6.44287 8.38394 12.5077 15.392 numMergedOcc 0
24 mol 43 unq 0 iso 0 dist 6.20293 8.80331 8.13395 8.95682 8.38399 6.18002 5.06502 5.73819 10.5523 12.3649 numMergedOcc 0
25 mol 43 unq 1 iso 0 dist 6.20293 8.80331 8.13395 8.95682 8.38399 6.18002 6.45462 8.93915 14.7803 14.3789 numMergedOcc 0
26 mol 58 unq 0 iso 0 dist 9.55426 6.81627 9.7274 7.21955 5.74871 7.09066 10.6169 9.4099 15.2973 12.3035 numMergedOcc 0
27 mol 58 unq 1 iso 0 dist 9.55426 7.32874 5.90225 7.21955 5.74871 7.12541 10.6169 9.4099 11.396 12.3035 numMergedOcc 0
28 mol 59 unq 0 iso 0 dist 7.71095 8.84665 12.5396 6.73347 9.64444 4.36133 10.0246 6.85766 17.79 14.8852 numMergedOcc 0
29 mol 59 unq 1 iso 0 dist 7.71095 8.25513 8.19458 6.73347 9.64444 6.66692 10.0246 6.85766 14.0127 14.8852 numMergedOcc 0
30 mol 72 unq 0 iso 0 dist 9.96708 8.8178 10.7394 9.27838 11.6378 15.434 8.24309 9.78528 9.84449 16.0048 numMergedOcc 0
31 mol 73 unq 0 iso 0 dist 9.96396 6.19304 5.4148 9.24757 5.11416 6.56633 15.7123 9.38498 10.2049 13.8696 numMergedOcc 0
32 mol 73 unq 1 iso 0 dist 9.96396 6.19304 5.4148 9.24757 5.11416 6.56633 12.016 9.75218 11.6369 13.0145 numMergedOcc 0
33 mol 73 unq 2 iso 0 dist 9.96396 8.70481 14.9342 9.24757 5.11416 15.3808 15.7123 9.38498 20.257 13.8696 numMergedOcc 0
34 mol 73 unq 3 iso 0 dist 9.96396 8.70481 14.9342 9.24757 5.11416 15.3808 12.016 9.75218 10.1207 13.0145 numMergedOcc 0
35 mol 85 unq 0 iso 0 dist 7.97049 7.47541 6.9948 9.82915 9.29301 13.5116 5.42586 6.19965 7.66905 12.0078 numMergedOcc 0
36 mol 85 unq 1 iso 0 dist 7.47541 7.97049 6.9948 9.82915 13.5116 9.29301 5.42586 7.66905 6.19965 12.0078 numMergedOcc 0
37 mol 85 unq 2 iso 0 dist 7.47541 7.97049 6.9948 9.82915 13.5116 9.29301 6.87425 5.73196 11.2656 14.4382 numMergedOcc 0
38 mol 85 unq 3 iso 0 dist 6.19965 7.95579 4.26409 7.54568 8.09967 10.2865 5.42586 7.97049 11.3023 10.0796 numMergedOcc 0
39 mol 85 unq 4 iso 0 dist 6.19965 7.66905 6.9948 7.54568 8.09967 4.65335 5.42586 7.97049 7.47541 10.0796 numMergedOcc 0
40 mol 85 unq 5 iso 0 dist 7.66905 7.95579 10.7229 7.54568 4.65335 10.2865 5.42586 7.47541 11.3023 10.0796 numMergedOcc 0
41 mol 85 unq 6 iso 0 dist 7.66905 7.95579 10.7229 7.54568 4.65335 10.2865 10.1164 5.73196 15.309 9.39864 numMergedOcc 0
42 mol 85 unq 7 iso 0 dist 7.66905 6.19965 6.9948 7.54568 4.65335 8.09967 5.42586 7.47541 7.97049 10.0796 numMergedOcc 0
43 mol 85 unq 8 iso 0 dist 7.66905 6.19965 6.9948 7.54568 4.65335 8.09967 10.1164 5.73196 11.2656 9.39864 numMergedOcc 0
44 mol 95 unq 0 iso 0 dist 8.03644 9.03572 16.6055 9.49454 11.4333 13.3662 8.41707 7.27724 16.9836 12.1092 numMergedOcc 0
45 mol 95 unq 1 iso 0 dist 8.03644 8.83255 13.8105 9.49454 11.4333 12.0666 8.41707 7.27724 16.9811 12.1092 numMergedOcc 0
46 mol 100 unq 0 iso 0 dist 9.60661 7.17106 11.5403 7.01812 5.80144 8.4128 5.88134 6.65086 10.5134 8.30845 numMergedOcc 0
47 mol 100 unq 1 iso 0 dist 9.60661 9.35224 7.80879 7.01812 5.80144 10.0456 5.88134 6.65086 6.56369 8.30845 numMergedOcc 0
48 mol 100 unq 2 iso 0 dist 9.35224 9.60661 7.80879 7.01812 10.0456 5.80144 5.88134 6.56369 6.65086 8.30845 numMergedOcc 0
49 mol 100 unq 3 iso 0 dist 9.35224 7.17106 8.87654 7.01812 10.0456 8.4128 5.88134 6.56369 10.5134 8.30845 numMergedOcc 0
50 mol 100 unq 4 iso 0 dist 7.47343 6.45675 5.33144 7.38135 11.2312 7.11701 8.8807 6.65086 10.1409 15.4031 numMergedOcc 0
51 mol 100 unq 5 iso 0 dist 7.47343 6.45675 5.33144 7.38135 11.2312 7.11701 12.6515 6.56369 11.8665 17.2419 numMergedOcc 0
52 mol 100 unq 6 iso 0 dist 7.47343 6.45675 5.33144 7.38135 11.2312 7.11701 13.887 9.30209 13.912 19.8941 numMergedOcc 0
53 mol 100 unq 7 iso 0 dist 7.47343 8.86688 10.1407 7.38135 11.2312 7.79768 8.8807 6.65086 14.9102 15.4031 numMergedOcc 0
54 mol 100 unq 8 iso 0 dist 7.47343 8.86688 10.1407 7.38135 11.2312 7.79768 12.6515 6.56369 13.6959 17.2419 numMergedOcc 0
55 mol 100 unq 9 iso 0 dist 7.47343 8.86688 10.1407 7.38135 11.2312 7.79768 13.887 9.30209 18.2109 19.8941 numMergedOcc 0
56 mol 100 unq 10 iso 0 dist 7.47343 6.65086 8.8807 8.30845 12.2861 5.80144 5.33144 6.45675 10.1409 10.6086 numMergedOcc 0
57 mol 100 unq 11 iso 0 dist 7.47343 6.65086 8.8807 8.30845 12.2861 5.80144 10.1407 8.86688 14.9102 18.1777 numMergedOcc 0
58 mol 100 unq 12 iso 0 dist 7.47343 6.65086 8.8807 8.76378 15.5385 12.3577 5.33144 6.45675 10.1409 13.2102 numMergedOcc 0
59 mol 100 unq 13 iso 0 dist 7.47343 6.65086 8.8807 8.76378 15.5385 12.3577 10.1407 8.86688 14.9102 14.0386 numMergedOcc 0
60 mol 100 unq 14 iso 0 dist 7.47343 6.56369 12.6515 8.30845 12.2861 10.0456 5.33144 6.45675 11.8665 10.6086 numMergedOcc 0
61 mol 100 unq 15 iso 0 dist 7.47343 6.56369 12.6515 8.30845 12.2861 10.0456 10.1407 8.86688 13.6959 18.1777 numMergedOcc 0
62 mol 100 unq 16 iso 0 dist 7.47343 6.56369 12.6515 8.76378 15.5385 4.97045 5.33144 6.45675 11.8665 13.2102 numMergedOcc 0
63 mol 100 unq 17 iso 0 dist 7.47343 6.56369 12.6515 8.76378 15.5385 4.97045 10.1407 8.86688 13.6959 14.0386 numMergedOcc 0
64 mol 100 unq 18 iso 0 dist 7.47343 9.30209 13.887 8.30845 12.2861 6.70236 5.33144 6.45675 13.912 10.6086 numMergedOcc 0
65 mol 100 unq 19 iso 0 dist 7.47343 9.30209 13.887 8.30845 12.2861 6.70236 10.1407 8.86688 18.2109 18.1777 numMergedOcc 0
66 mol 100 unq 20 iso 0 dist 7.47343 9.30209 13.887 8.76378 15.5385 10.7791 5.33144 6.45675 13.912 13.2102 numMergedOcc 0
67 mol 100 unq 21 iso 0 dist 7.47343 9.30209 13.887 8.76378 15.5385 10.7791 10.1407 8.86688 18.2109 14.0386 numMergedOcc 0
68 mol 100 unq 22 iso 0 dist 6.65086 7.47343 8.8807 8.30845 5.80144 12.2861 5.88134 9.60661 12.0662 7.01812 numMergedOcc 0
69 mol 100 unq 23 iso 0 dist 6.65086 7.47343 8.8807 8.76378 12.3577 15.5385 5.88134 9.60661 12.0662 10.0635 numMergedOcc 0
70 mol 100 unq 24 iso 0 dist 6.65086 6.56369 7.80879 8.30845 5.80144 10.0456 5.88134 9.60661 9.35224 7.01812 numMergedOcc 0
71 mol 100 unq 25 iso 0 dist 6.65086 6.56369 7.80879 8.76378 12.3577 4.97045 5.88134 9.60661 9.35224 10.0635 numMergedOcc 0
72 mol 100 unq 26 iso 0 dist 6.65086 9.30209 5.38414 8.30845 5.80144 6.70236 5.88134 9.60661 10.5853 7.01812 numMergedOcc 0
73 mol 100 unq 27 iso 0 dist 6.65086 9.30209 5.38414 8.76378 12.3577 10.7791 5.88134 9.60661 10.5853 10.0635 numMergedOcc 0
74 mol 100 unq 28 iso 0 dist 6.56369 7.47343 12.6515 8.30845 10.0456 12.2861 5.88134 9.35224 12.0662 7.01812 numMergedOcc 0
75 mol 100 unq 29 iso 0 dist 6.56369 7.47343 12.6515 8.76378 4.97045 15.5385 5.88134 9.35224 12.0662 10.0635 numMergedOcc 0
76 mol 100 unq 30 iso 0 dist 6.56369 6.65086 7.80879 8.30845 10.0456 5.80144 5.88134 9.35224 9.60661 7.01812 numMergedOcc 0
77 mol 100 unq 31 iso 0 dist 6.56369 6.65086 7.80879 8.76378 4.97045 12.3577 5.88134 9.35224 9.60661 10.0635 numMergedOcc 0
78 mol 100 unq 32 iso 0 dist 6.56369 9.30209 6.39938 8.30845 10.0456 6.70236 5.88134 9.35224 10.5853 7.01812 numMergedOcc 0
79 mol 100 unq 33 iso 0 dist 6.56369 9.30209 6.39938 8.76378 4.97045 10.7791 5.88134 9.35224 10.5853 10.0635 numMergedOcc 0
80 mol 115 unq 0 iso 0 dist 7.11972 6.90986 10.498 5.88249 6.77806 5.31484 6.5838 5.11551 11.4095 6.92026 numMergedOcc 0
81 mol 115 unq 1 iso 0 dist 6.90986 7.11972 10.498 5.88249 5.31484 6.77806 5.67807 5.39945 11.8863 6.97707 numMergedOcc 0
82 mol 133 unq 0 iso 0 dist 9.52634 6.5107 9.56949 6.66772 4.34568 7.12976 6.69554 9.91388 9.66421 9.97654 numMergedOcc 0
83 mol 133 unq 1 iso 0 dist 9.52634 6.5107 9.56949 6.66772 4.34568 7.12976 7.6656 7.24514 12.0352 7.71248 numMergedOcc 0
84 mol 133 unq 2 iso 0 dist 7.24514 8.22656 6.65743 7.71248 4.34568 10.6025 6.761 9.91388 10.0372 9.97654 numMergedOcc 0
85 mol 133 unq 3 iso 0 dist 7.24514 8.22656 6.65743 7.71248 4.34568 10.6025 7.6656 9.52634 13.4163 6.66772 numMergedOcc 0
86 mol 133 unq 4 iso 0 dist 8.22656 7.24514 6.65743 7.71248 10.6025 4.34568 5.61668 6.82262 10.2995 12.4749 numMergedOcc 0
87 mol 134 unq 0 iso 0 dist 6.54501 6.49416 5.00526 7.80532 7.41674 9.87376 5.79898 9.89303 9.93925 5.83771 numMergedOcc 0
88 mol 134 unq 1 iso 0 dist 6.54501 9.89303 5.79898 7.69991 5.71679 4.60632 5.00526 6.49416 9.93925 6.23142 numMergedOcc 0
89 mol 134 unq 2 iso 0 dist 8.94367 6.37586 5.49782 6.23142 4.57832 5.29786 6.81259 9.86662 9.71307 9.94764 numMergedOcc 0
90 mol 134 unq 3 iso 0 dist 8.94367 6.49416 8.80819 6.23142 4.57832 5.71679 6.81259 9.86662 12.5075 9.94764 numMergedOcc 0
91 mol 134 unq 4 iso 0 dist 6.37586 8.94367 5.49782 6.23142 5.29786 4.57832 6.81259 9.71307 9.86662 9.94764 numMergedOcc 0
92 mol 134 unq 5 iso 0 dist 6.37586 6.49416 5.00817 6.23142 5.29786 5.71679 6.81259 9.71307 12.5075 9.94764 numMergedOcc 0
93 mol 134 unq 6 iso 0 dist 6.49416 6.54501 5.00526 7.80532 9.87376 7.41674 8.80819 8.94367 11.9139 10.5252 numMergedOcc 0
94 mol 134 unq 7 iso 0 dist 6.49416 6.54501 5.00526 7.80532 9.87376 7.41674 5.00817 6.37586 9.5126 10.7586 numMergedOcc 0
95 mol 134 unq 8 iso 0 dist 6.49416 8.94367 8.80819 6.23142 5.71679 4.57832 5.00526 6.54501 11.9139 7.69991 numMergedOcc 0
96 mol 134 unq 9 iso 0 dist 6.49416 6.37586 5.00817 6.23142 5.71679 5.29786 5.00526 6.54501 9.5126 7.69991 numMergedOcc 0
97 mol 134 unq 10 iso 0 dist 9.86662 9.71307 5.49782 9.94764 4.57832 5.29786 6.81259 8.94367 6.37586 6.23142 numMergedOcc 0
98 mol 134 unq 11 iso 0 dist 9.71307 9.86662 5.49782 9.94764 5.29786 4.57832 6.81259 6.37586 8.94367 6.23142 numMergedOcc 0
99 mol 156 unq 0 iso 0 dist 8.94056 7.44554 5.56175 9.4013 6.13574 5.71511 10.1658 7.66148 12.0598 11.1147 numMergedOcc 0
100 mol 156 unq 1 iso 0 dist 8.94056 9.83699 11.2719 9.4013 6.13574 5.80008 10.1658 7.66148 15.1382 11.1147 numMergedOcc 0
101 mol 156 unq 2 iso 0 dist 8.94056 7.66148 10.1658 7.90267 5.4555 6.03934 5.56175 7.44554 12.0598 9.44367 numMergedOcc 0
102 mol 156 unq 3 iso 0 dist 8.94056 7.66148 10.1658 7.90267 5.4555 6.03934 11.2719 9.83699 15.1382 10.3379 numMergedOcc 0
103 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 8.90963 8.91338 9.81073 13.2049 8.03334 10.7062 16.082 numMergedOcc 0
104 mol 181 unq 1 iso 0 dist 9.1374 9.15386 12.1628 8.90963 8.91338 9.34211 13.2049 8.03334 14.9794 16.082 numMergedOcc 0
105 mol 181 unq 2 iso 0 dist 9.1374 8.03334 13.2049 6.2479 6.6251 7.81713 8.88798 5.98885 10.7062 7.99195 numMergedOcc 0
106 mol 181 unq 3 iso 0 dist 9.1374 8.03334 13.2049 6.2479 6.6251 7.81713 12.1628 9.15386 14.9794 12.8533 numMergedOcc 0
107 mol 181 unq 4 iso 0 dist 5.98885 9.1374 8.88798 8.90963 9.81073 8.91338 10.1912 9.09537 15.0228 18.0578 numMergedOcc 0
108 mol 181 unq 5 iso 0 dist 5.98885 9.15386 5.16002 8.90963 9.81073 9.34211 10.1912 9.09537 12.9862 18.0578 numMergedOcc 0
109 mol 181 unq 6 iso 0 dist 5.98885 9.09537 10.1912 9.72611 5.6044 12.9468 8.88798 9.1374 15.0228 14.2254 numMergedOcc 0
110 mol 181 unq 7 iso 0 dist 5.98885 9.09537 10.1912 9.72611 5.6044 12.9468 5.16002 9.15386 12.9862 10.428 numMergedOcc 0
111 mol 181 unq 8 iso 0 dist 5.98885 9.09537 10.1912 7.99195 6.6251 10.09 8.88798 9.1374 15.0228 6.2479 numMergedOcc 0
112 mol 181 unq 9 iso 0 dist 5.98885 9.09537 10.1912 7.99195 6.6251 10.09 5.16002 9.15386 12.9862 12.8533 numMergedOcc 0
113 mol 206 unq 0 iso 0 dist 9.774 8.02137 10.4 7.75885 6.45859 12.7604 5.63422 7.7366 11.1804 6.16414 numMergedOcc 0
114 mol 227 unq 0 iso 0 dist 7.22101 9.34734 6.99063 7.43071 6.35849 6.00424 4.39704 7.09863 10.4905 6.02296 numMergedOcc 0
115 mol 227 unq 1 iso 0 dist 7.22101 9.34734 6.99063 5.41321 10.9607 10.7656 4.39704 7.09863 10.4905 9.74265 numMergedOcc 0
116 mol 227 unq 2 iso 0 dist 7.22101 8.65997 5.22356 7.43071 6.35849 10.204 4.39704 7.09863 10.8157 6.02296 numMergedOcc 0
117 mol 227 unq 3 iso 0 dist 7.22101 8.65997 5.22356 5.41321 10.9607 9.72615 4.39704 7.09863 10.8157 9.74265 numMergedOcc 0
118 mol 227 unq 4 iso 0 dist 7.22101 7.56888 10.8658 7.43071 6.35849 9.76735 4.39704 7.09863 11.0431 6.02296 numMergedOcc 0
119 mol 227 unq 5 iso 0 dist 7.22101 7.56888 10.8658 5.41321 10.9607 5.10635 4.39704 7.09863 11.0431 9.74265 numMergedOcc 0
120 mol 227 unq 6 iso 0 dist 7.22101 7.55216 12.4689 7.43071 6.35849 9.32448 4.39704 7.09863 10.0334 6.02296 numMergedOcc 0
121 mol 227 unq 7 iso 0 dist 7.22101 7.55216 12.4689 5.41321 10.9607 6.48027 4.39704 7.09863 10.0334 9.74265 numMergedOcc 0
122 mol 234 unq 0 iso 0 dist 6.56247 8.34494 6.29886 9.81425 4.46561 4.3717 5.88703 9.45496 12.9605 13.293 numMergedOcc 0
123 mol 234 unq 1 iso 0 dist 6.56247 9.36357 7.82322 9.81425 4.46561 10.641 5.88703 9.45496 6.7625 13.293 numMergedOcc 0
124 mol 234 unq 2 iso 0 dist 9.36357 8.34494 12.1694 9.81425 10.641 4.3717 5.88703 6.7625 12.9605 13.293 numMergedOcc 0
125 mol 234 unq 3 iso 0 dist 9.36357 6.56247 7.82322 9.81425 10.641 4.46561 5.88703 6.7625 9.45496 13.293 numMergedOcc 0
126 mol 259 unq 0 iso 0 dist 8.13497 7.88519 4.69778 7.98231 8.41846 8.81835 10.582 8.53687 10.5767 15.5791 numMergedOcc 0
127 mol 259 unq 1 iso 0 dist 7.88519 8.13497 4.69778 7.98231 8.81835 8.41846 4.86771 7.84554 9.95973 11.6972 numMergedOcc 0
128 mol 259 unq 2 iso 0 dist 7.88519 8.13497 4.69778 7.98231 8.81835 8.41846 6.96053 7.46176 10.3935 7.08526 numMergedOcc 0
129 mol 259 unq 3 iso 0 dist 7.88519 8.13497 4.69778 7.98231 8.81835 8.41846 10.4881 9.18903 12.6839 15.8414 numMergedOcc 0
130 mol 261 unq 0 iso 0 dist 8.43057 8.02547 10.0727 8.43974 8.29908 5.91643 10.1239 7.73141 14.2688 14.8495 numMergedOcc 0
131 mol 261 unq 1 iso 0 dist 8.43057 6.05727 4.63549 8.43974 8.29908 5.02383 10.1239 7.73141 10.0703 14.8495 numMergedOcc 0
