0 mol 27 unq 0 iso 0 dist 9.48375 6.85127 5.50074 8.16102 16.7495 12.314 numMergedOcc 0
1 mol 27 unq 0 iso 1 dist 6.85127 9.48375 5.50074 8.16102 12.314 16.7495 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 9.48375 8.58169 13.8682 8.16102 16.7495 6.16154 numMergedOcc 0
3 mol 27 unq 1 iso 1 dist 8.58169 9.48375 13.8682 8.16102 6.16154 16.7495 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 6.85127 8.58169 8.79378 8.16102 12.314 6.16154 numMergedOcc 0
5 mol 27 unq 1 iso 1 dist 8.58169 6.85127 8.79378 8.16102 6.16154 12.314 numMergedOcc 0
6 mol 55 unq 0 iso 0 dist 4.70371 8.74565 12.2062 8.77395 8.20593 13.1058 numMergedOcc 0
7 mol 55 unq 0 iso 1 dist 8.74565 4.70371 12.2062 8.77395 13.1058 8.20593 numMergedOcc 0
8 mol 55 unq 1 iso 0 dist 4.70371 8.74565 12.2062 6.91288 6.20434 14.3366 numMergedOcc 0
9 mol 55 unq 1 iso 1 dist 8.74565 4.70371 12.2062 6.91288 14.3366 6.20434 numMergedOcc 0
10 mol 55 unq 2 iso 0 dist 4.70371 8.74565 12.2062 8.60087 9.61184 9.31655 numMergedOcc 0
11 mol 55 unq 2 iso 1 dist 8.74565 4.70371 12.2062 8.60087 9.31655 9.61184 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 5.72494 8.70106 6.73664 7.85115 11.4876 11.2795 numMergedOcc 0
13 mol 103 unq 0 iso 1 dist 8.70106 5.72494 6.73664 7.85115 11.2795 11.4876 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 8.60157 6.72591 10.8037 7.91749 3.54257 8.03052 numMergedOcc 0
15 mol 148 unq 0 iso 1 dist 6.72591 8.60157 10.8037 7.91749 8.03052 3.54257 numMergedOcc 0
16 mol 150 unq 0 iso 0 dist 8.59359 6.80192 10.8647 7.96309 3.59609 8.06512 numMergedOcc 0
17 mol 150 unq 0 iso 1 dist 6.80192 8.59359 10.8647 7.96309 8.06512 3.59609 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 7.03216 9.42196 9.61687 8.43599 5.28013 5.89583 numMergedOcc 0
19 mol 182 unq 0 iso 1 dist 9.42196 7.03216 9.61687 8.43599 5.89583 5.28013 numMergedOcc 0
20 mol 247 unq 0 iso 0 dist 6.56182 5.32075 11.3859 5.27761 6.27547 7.88685 numMergedOcc 0
21 mol 247 unq 0 iso 1 dist 5.32075 6.56182 11.3859 5.27761 7.88685 6.27547 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 9.73318 5.75551 6.53265 8.45998 10.208 8.59509 numMergedOcc 0
23 mol 250 unq 0 iso 1 dist 5.75551 9.73318 6.53265 8.45998 8.59509 10.208 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 6.15396 9.18964 5.92133 8.36459 4.4471 10.1631 numMergedOcc 0
25 mol 282 unq 0 iso 1 dist 9.18964 6.15396 5.92133 8.36459 10.1631 4.4471 numMergedOcc 0
26 mol 283 unq 0 iso 0 dist 8.07626 6.3448 7.89565 8.3831 9.07999 7.39416 numMergedOcc 0
27 mol 283 unq 0 iso 1 dist 6.3448 8.07626 7.89565 8.3831 7.39416 9.07999 numMergedOcc 0
28 mol 283 unq 1 iso 0 dist 8.07626 6.3448 7.89565 8.44179 5.0232 5.78526 numMergedOcc 0
29 mol 283 unq 1 iso 1 dist 6.3448 8.07626 7.89565 8.44179 5.78526 5.0232 numMergedOcc 0
30 mol 285 unq 0 iso 0 dist 9.03396 4.09984 7.91838 6.41777 4.39911 5.42273 numMergedOcc 0
31 mol 285 unq 0 iso 1 dist 4.09984 9.03396 7.91838 6.41777 5.42273 4.39911 numMergedOcc 0
