0 mol 8 unq 0 iso 0 dist 9.95422 8.89145 12.7683 6.92865 12.3778 8.02605 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 9.95422 6.92865 12.3778 8.89145 12.7683 8.02605 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 7.65219 8.89145 13.0138 6.92865 5.95251 8.02605 numMergedOcc 0
3 mol 8 unq 1 iso 1 dist 7.65219 6.92865 5.95251 8.89145 13.0138 8.02605 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 6.8824 7.78708 5.3957 7.84393 10.38 8.01051 numMergedOcc 0
5 mol 19 unq 0 iso 1 dist 6.8824 7.84393 10.38 7.78708 5.3957 8.01051 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 8.33492 7.78708 10.6828 7.84393 6.01189 8.01051 numMergedOcc 0
7 mol 19 unq 1 iso 1 dist 8.33492 7.84393 6.01189 7.78708 10.6828 8.01051 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 7.32268 8.24121 8.0675 8.52371 12.8766 10.149 numMergedOcc 0
9 mol 69 unq 0 iso 1 dist 7.32268 8.52371 12.8766 8.24121 8.0675 10.149 numMergedOcc 0
10 mol 69 unq 1 iso 0 dist 7.32268 8.24121 8.0675 6.8198 7.98306 12.0119 numMergedOcc 0
11 mol 69 unq 1 iso 1 dist 7.32268 6.8198 7.98306 8.24121 8.0675 12.0119 numMergedOcc 0
12 mol 69 unq 1 iso 0 dist 7.32268 8.52371 12.8766 6.8198 7.98306 9.16015 numMergedOcc 0
13 mol 69 unq 1 iso 1 dist 7.32268 6.8198 7.98306 8.52371 12.8766 9.16015 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 9.36674 7.44784 6.06198 9.56867 16.6569 11.5723 numMergedOcc 0
15 mol 115 unq 0 iso 1 dist 9.36674 9.56867 16.6569 7.44784 6.06198 11.5723 numMergedOcc 0
16 mol 132 unq 0 iso 0 dist 7.73306 6.495 11.6877 9.43748 11.8999 4.35917 numMergedOcc 0
17 mol 132 unq 0 iso 1 dist 7.73306 9.43748 11.8999 6.495 11.6877 4.35917 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.84695 5.67862 8.44345 7.97208 7.46245 5.00817 numMergedOcc 0
19 mol 134 unq 0 iso 1 dist 8.84695 7.97208 7.46245 5.67862 8.44345 5.00817 numMergedOcc 0
20 mol 140 unq 0 iso 0 dist 9.35707 9.41832 12.5321 5.44596 11.9489 6.43459 numMergedOcc 0
21 mol 140 unq 0 iso 1 dist 9.35707 5.44596 11.9489 9.41832 12.5321 6.43459 numMergedOcc 0
22 mol 140 unq 1 iso 0 dist 9.35707 9.41832 12.5321 9.69069 4.95731 8.90548 numMergedOcc 0
23 mol 140 unq 1 iso 1 dist 9.35707 9.69069 4.95731 9.41832 12.5321 8.90548 numMergedOcc 0
24 mol 140 unq 1 iso 0 dist 9.35707 5.44596 11.9489 9.69069 4.95731 9.87462 numMergedOcc 0
25 mol 140 unq 1 iso 1 dist 9.35707 9.69069 4.95731 5.44596 11.9489 9.87462 numMergedOcc 0
26 mol 175 unq 0 iso 0 dist 9.30469 6.73365 12.0877 9.45659 9.79219 5.35493 numMergedOcc 0
27 mol 175 unq 0 iso 1 dist 9.30469 9.45659 9.79219 6.73365 12.0877 5.35493 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 9.30469 6.73365 12.0877 9.44856 5.94412 9.63234 numMergedOcc 0
29 mol 175 unq 1 iso 1 dist 9.30469 9.44856 5.94412 6.73365 12.0877 9.63234 numMergedOcc 0
30 mol 175 unq 1 iso 0 dist 9.30469 9.45659 9.79219 9.44856 5.94412 6.80157 numMergedOcc 0
31 mol 175 unq 1 iso 1 dist 9.30469 9.44856 5.94412 9.45659 9.79219 6.80157 numMergedOcc 0
32 mol 185 unq 0 iso 0 dist 9.16317 8.12755 5.90192 8.94984 12.1266 7.92846 numMergedOcc 0
33 mol 185 unq 0 iso 1 dist 9.16317 8.94984 12.1266 8.12755 5.90192 7.92846 numMergedOcc 0
34 mol 219 unq 0 iso 0 dist 9.48678 8.09769 13.0834 7.24832 6.90908 7.02195 numMergedOcc 0
35 mol 219 unq 0 iso 1 dist 9.48678 7.24832 6.90908 8.09769 13.0834 7.02195 numMergedOcc 0
36 mol 220 unq 0 iso 0 dist 6.45234 7.30244 8.70715 7.29796 10.898 6.89336 numMergedOcc 0
37 mol 220 unq 0 iso 1 dist 6.45234 7.29796 10.898 7.30244 8.70715 6.89336 numMergedOcc 0
38 mol 223 unq 0 iso 0 dist 9.03969 9.94212 10.6103 7.34316 4.21803 12.3422 numMergedOcc 0
39 mol 223 unq 0 iso 1 dist 9.03969 7.34316 4.21803 9.94212 10.6103 12.3422 numMergedOcc 0
40 mol 230 unq 0 iso 0 dist 9.26431 8.56954 5.56464 9.23938 10.1392 5.53477 numMergedOcc 0
41 mol 230 unq 0 iso 1 dist 9.26431 9.23938 10.1392 8.56954 5.56464 5.53477 numMergedOcc 0
42 mol 240 unq 0 iso 0 dist 6.87809 6.01168 6.24198 7.72928 5.90601 4.28414 numMergedOcc 0
43 mol 240 unq 0 iso 1 dist 6.87809 7.72928 5.90601 6.01168 6.24198 4.28414 numMergedOcc 0
44 mol 276 unq 0 iso 0 dist 9.15041 8.95876 5.88008 8.259 9.98469 8.61035 numMergedOcc 0
45 mol 276 unq 0 iso 1 dist 9.15041 8.259 9.98469 8.95876 5.88008 8.61035 numMergedOcc 0
46 mol 282 unq 0 iso 0 dist 9.06244 6.84554 6.17747 9.51581 7.94567 4.66602 numMergedOcc 0
47 mol 282 unq 0 iso 1 dist 9.06244 9.51581 7.94567 6.84554 6.17747 4.66602 numMergedOcc 0
48 mol 284 unq 0 iso 0 dist 7.78736 7.2795 11.6982 9.41428 15.042 5.87439 numMergedOcc 0
49 mol 284 unq 0 iso 1 dist 7.78736 9.41428 15.042 7.2795 11.6982 5.87439 numMergedOcc 0
50 mol 284 unq 1 iso 0 dist 8.19742 7.2795 5.36955 9.41428 10.6793 5.87439 numMergedOcc 0
51 mol 284 unq 1 iso 1 dist 8.19742 9.41428 10.6793 7.2795 5.36955 5.87439 numMergedOcc 0
