0 mol 18 unq 0 iso 0 dist 6.79099 13.4014 9.51761 5.27833 7.3094 9.70492 9.05986 5.65084 12.6536 9.36767 numMergedOcc 0
1 mol 18 unq 0 iso 1 dist 6.79099 5.27833 7.3094 13.4014 9.51761 9.70492 9.05986 5.65084 9.36767 12.6536 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.16827 7.23774 5.73819 12.092 6.20293 5.06502 10.4149 6.75943 4.96926 5.41726 numMergedOcc 0
3 mol 43 unq 0 iso 1 dist 9.16827 12.092 6.20293 7.23774 5.73819 5.06502 10.4149 6.75943 5.41726 4.96926 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.16827 7.23774 5.73819 10.7423 8.93915 5.89973 10.4149 6.75943 4.96926 10.0383 numMergedOcc 0
5 mol 43 unq 1 iso 1 dist 9.16827 10.7423 8.93915 7.23774 5.73819 5.89973 10.4149 6.75943 10.0383 4.96926 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.16827 12.092 6.20293 10.7423 8.93915 6.45462 10.4149 6.75943 5.41726 10.0383 numMergedOcc 0
7 mol 43 unq 1 iso 1 dist 9.16827 10.7423 8.93915 12.092 6.20293 6.45462 10.4149 6.75943 10.0383 5.41726 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 7.15486 6.58144 6.64012 4.98107 9.4099 6.47414 7.43516 9.08221 4.00553 8.55984 numMergedOcc 0
9 mol 58 unq 0 iso 1 dist 7.15486 4.98107 9.4099 6.58144 6.64012 6.47414 7.43516 9.08221 8.55984 4.00553 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 5.09688 9.65979 6.45675 12.2879 7.47343 5.33144 10.9005 7.82475 5.43561 5.9143 numMergedOcc 0
11 mol 100 unq 0 iso 1 dist 5.09688 12.2879 7.47343 9.65979 6.45675 5.33144 10.9005 7.82475 5.9143 5.43561 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 5.09688 9.65979 6.45675 12.2879 7.47343 5.33144 9.06539 5.35782 6.30222 5.47563 numMergedOcc 0
13 mol 100 unq 1 iso 1 dist 5.09688 12.2879 7.47343 9.65979 6.45675 5.33144 9.06539 5.35782 5.47563 6.30222 numMergedOcc 0
14 mol 100 unq 2 iso 0 dist 5.09688 9.65979 6.45675 10.2364 8.86688 9.71151 10.9005 7.82475 5.43561 5.25234 numMergedOcc 0
15 mol 100 unq 2 iso 1 dist 5.09688 10.2364 8.86688 9.65979 6.45675 9.71151 10.9005 7.82475 5.25234 5.43561 numMergedOcc 0
16 mol 100 unq 3 iso 0 dist 5.09688 9.65979 6.45675 10.2364 8.86688 9.71151 9.06539 5.35782 6.30222 5.03232 numMergedOcc 0
17 mol 100 unq 3 iso 1 dist 5.09688 10.2364 8.86688 9.65979 6.45675 9.71151 9.06539 5.35782 5.03232 6.30222 numMergedOcc 0
18 mol 100 unq 2 iso 0 dist 5.09688 12.2879 7.47343 10.2364 8.86688 10.1407 10.9005 7.82475 5.9143 5.25234 numMergedOcc 0
19 mol 100 unq 2 iso 1 dist 5.09688 10.2364 8.86688 12.2879 7.47343 10.1407 10.9005 7.82475 5.25234 5.9143 numMergedOcc 0
20 mol 100 unq 3 iso 0 dist 5.09688 12.2879 7.47343 10.2364 8.86688 10.1407 9.06539 5.35782 5.47563 5.03232 numMergedOcc 0
21 mol 100 unq 3 iso 1 dist 5.09688 10.2364 8.86688 12.2879 7.47343 10.1407 9.06539 5.35782 5.03232 5.47563 numMergedOcc 0
22 mol 100 unq 4 iso 0 dist 9.26343 13.666 6.45675 16.4386 7.47343 5.33144 16.0043 7.82475 5.43561 5.9143 numMergedOcc 0
23 mol 100 unq 4 iso 1 dist 9.26343 16.4386 7.47343 13.666 6.45675 5.33144 16.0043 7.82475 5.9143 5.43561 numMergedOcc 0
24 mol 100 unq 5 iso 0 dist 9.26343 13.666 6.45675 16.4386 7.47343 5.33144 14.1132 5.35782 6.30222 5.47563 numMergedOcc 0
25 mol 100 unq 5 iso 1 dist 9.26343 16.4386 7.47343 13.666 6.45675 5.33144 14.1132 5.35782 5.47563 6.30222 numMergedOcc 0
26 mol 100 unq 6 iso 0 dist 9.26343 13.666 6.45675 15.5646 8.86688 9.71151 16.0043 7.82475 5.43561 5.25234 numMergedOcc 0
27 mol 100 unq 6 iso 1 dist 9.26343 15.5646 8.86688 13.666 6.45675 9.71151 16.0043 7.82475 5.25234 5.43561 numMergedOcc 0
28 mol 100 unq 7 iso 0 dist 9.26343 13.666 6.45675 15.5646 8.86688 9.71151 14.1132 5.35782 6.30222 5.03232 numMergedOcc 0
29 mol 100 unq 7 iso 1 dist 9.26343 15.5646 8.86688 13.666 6.45675 9.71151 14.1132 5.35782 5.03232 6.30222 numMergedOcc 0
30 mol 100 unq 6 iso 0 dist 9.26343 16.4386 7.47343 15.5646 8.86688 10.1407 16.0043 7.82475 5.9143 5.25234 numMergedOcc 0
31 mol 100 unq 6 iso 1 dist 9.26343 15.5646 8.86688 16.4386 7.47343 10.1407 16.0043 7.82475 5.25234 5.9143 numMergedOcc 0
32 mol 100 unq 7 iso 0 dist 9.26343 16.4386 7.47343 15.5646 8.86688 10.1407 14.1132 5.35782 5.47563 5.03232 numMergedOcc 0
33 mol 100 unq 7 iso 1 dist 9.26343 15.5646 8.86688 16.4386 7.47343 10.1407 14.1132 5.35782 5.03232 5.47563 numMergedOcc 0
34 mol 117 unq 0 iso 0 dist 9.41387 6.54872 9.84395 9.3855 7.90328 13.1058 5.63489 6.10127 6.57678 10.5783 numMergedOcc 0
35 mol 117 unq 0 iso 1 dist 9.41387 9.3855 7.90328 6.54872 9.84395 13.1058 5.63489 6.10127 10.5783 6.57678 numMergedOcc 0
36 mol 204 unq 0 iso 0 dist 7.92766 14.0488 7.10633 7.58285 8.51516 10.8344 6.6094 7.9133 10.7169 5.57347 numMergedOcc 0
37 mol 204 unq 0 iso 1 dist 7.92766 7.58285 8.51516 14.0488 7.10633 10.8344 6.6094 7.9133 5.57347 10.7169 numMergedOcc 0
38 mol 205 unq 0 iso 0 dist 7.36642 4.87114 6.03031 9.43922 7.26832 7.38516 8.66359 6.52816 9.49403 13.514 numMergedOcc 0
39 mol 205 unq 0 iso 1 dist 7.36642 9.43922 7.26832 4.87114 6.03031 7.38516 8.66359 6.52816 13.514 9.49403 numMergedOcc 0
40 mol 205 unq 1 iso 0 dist 7.36642 4.87114 6.03031 6.98312 7.80463 8.18714 8.66359 6.52816 9.49403 3.56269 numMergedOcc 0
41 mol 205 unq 1 iso 1 dist 7.36642 6.98312 7.80463 4.87114 6.03031 8.18714 8.66359 6.52816 3.56269 9.49403 numMergedOcc 0
42 mol 205 unq 1 iso 0 dist 7.36642 9.43922 7.26832 6.98312 7.80463 13.8543 8.66359 6.52816 13.514 3.56269 numMergedOcc 0
43 mol 205 unq 1 iso 1 dist 7.36642 6.98312 7.80463 9.43922 7.26832 13.8543 8.66359 6.52816 3.56269 13.514 numMergedOcc 0
44 mol 214 unq 0 iso 0 dist 6.83122 9.3424 9.65138 12.2622 7.14453 9.10746 12.8946 7.46481 11.4955 8.459 numMergedOcc 0
45 mol 214 unq 0 iso 1 dist 6.83122 12.2622 7.14453 9.3424 9.65138 9.10746 12.8946 7.46481 8.459 11.4955 numMergedOcc 0
46 mol 214 unq 1 iso 0 dist 6.83122 9.3424 9.65138 6.75833 8.85478 4.40923 12.8946 7.46481 11.4955 11.1534 numMergedOcc 0
47 mol 214 unq 1 iso 1 dist 6.83122 6.75833 8.85478 9.3424 9.65138 4.40923 12.8946 7.46481 11.1534 11.4955 numMergedOcc 0
48 mol 214 unq 1 iso 0 dist 6.83122 12.2622 7.14453 6.75833 8.85478 11.3796 12.8946 7.46481 8.459 11.1534 numMergedOcc 0
49 mol 214 unq 1 iso 1 dist 6.83122 6.75833 8.85478 12.2622 7.14453 11.3796 12.8946 7.46481 11.1534 8.459 numMergedOcc 0
50 mol 238 unq 0 iso 0 dist 9.2521 12.8083 6.22714 10.1821 7.31233 5.34096 12.95 9.08509 12.7938 11.0772 numMergedOcc 0
51 mol 238 unq 0 iso 1 dist 9.2521 10.1821 7.31233 12.8083 6.22714 5.34096 12.95 9.08509 11.0772 12.7938 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 6.49599 14.1932 8.13497 13.8605 7.88519 4.69778 9.41512 9.46361 12.2293 11.6988 numMergedOcc 0
53 mol 259 unq 0 iso 1 dist 6.49599 13.8605 7.88519 14.1932 8.13497 4.69778 9.41512 9.46361 11.6988 12.2293 numMergedOcc 0
